
1. Dasanit O; Dasanit O analog; Dasanit O-analog ...
MW:     292.288442 g/mol MF: C11H17O5PS
IUPAC name: diethyl (4-methylsulfinylphenyl) phosphate
Create Date: 2005-03-26
CID: 81038

2. Famoxon; Famphur O-analog; Famphur-O-analog ...
MW:     309.275902 g/mol MF: C10H16NO6PS
IUPAC name: [4-(dimethylsulfamoyl)phenyl] dimethyl phosphate
Create Date: 2005-03-27
CID: 70399

3. Chlorpyrifos oxon; Dursbanoxon; Chloropyrifos oxon ...
MW:     334.520702 g/mol MF: C9H11Cl3NO4P
IUPAC name: diethyl (3,5,6-trichloropyridin-2-yl) phosphate
Create Date: 2005-03-27
CID: 21804

4. Fenitrooxone; Fenitrooxon; Fenitroxon ...
MW:     261.168442 g/mol MF: C9H12NO6P
IUPAC name: dimethyl (3-methyl-4-nitrophenyl) phosphate
Create Date: 2005-03-27
CID: 16738

5. OMETHOATE; Dimethoxon; Folimat ...
MW:     213.191842 g/mol MF: C5H12NO4PS
IUPAC name: 2-dimethoxyphosphorylsulfanyl-N-methylacetamide
Create Date: 2005-03-27
CID: 14210

6. Leptophos oxon; Leptophoxon; Phosvel oxon ...
MW:     396.000462 g/mol MF: C13H10BrCl2O3P
IUPAC name: 1-bromo-2,5-dichloro-4-[methoxy(phenyl)phosphoryl]oxybenzene
Create Date: 2005-03-27
CID: 32765

7. AcPyAD; [[5-(3-acetylpyridin-1-ium-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl][5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl hydrogen phosphate; 3-Acetyl NAD ...
MW:     663.444984 g/mol MF: C22H29N6O14P2+
IUPAC name: [[5-(3-acetylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]me...
Create Date: 2005-03-25
CID: 2011

8. 3-acetylpyridine adenine dinucleotide; 86-08-8; [(2r,3s,4r,5r)-5-(3-acetylpyridin-1-ium-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl[[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphate ...
MW:     662.437044 g/mol MF: C22H28N6O14P2
IUPAC name: [(2R,3S,4R,5R)-5-(3-acetylpyridin-1-ium-1-yl)-3,4-dihydroxyo...
Create Date: 2005-08-08
CID: 123926

9. Thionazin-O-analog; Zinophos O-analog; diethyl pyrazin-2-yl phosphate ...
MW:     232.173582 g/mol MF: C8H13N2O4P
IUPAC name: diethyl pyrazin-2-yl phosphate
Create Date: 2005-08-09
CID: 219041

10. 1-NM-PP1; 221244-14-0; PP1 Analog II, 1NM-PP1 ...
MW:     331.414240 g/mol MF: C20H21N5
IUPAC name: 1-tert-butyl-3-(naphthalen-1-ylmethyl)pyrazolo[3,4-d]pyrimid...
Create Date: 2005-09-26
CID: 5154691

11. Tamoxifen analog II; 1,1-Dichloro-2,3-diphenylcyclopropane; a.k.a. Analog II ...
MW:     263.161780 g/mol MF: C15H12Cl2
IUPAC name: (2,2-dichloro-3-phenylcyclopropyl)benzene
Create Date: 2005-03-26
CID: 115061

12. erbstatin analog; Methyl 2,5-dihydroxycinnamate; 63177-57-1 ...
MW:     194.184000 g/mol MF: C10H10O4
IUPAC name: methyl (E)-3-(2,5-dihydroxyphenyl)prop-2-enoate
Create Date: 2005-03-25
CID: 5353609

13. TENOCYCLIDINE; thienyl cyclohexylpiperidine; Tenociclidina ...
MW:     249.414820 g/mol MF: C15H23NS
IUPAC name: 1-(1-thiophen-2-ylcyclohexyl)piperidine
Create Date: 2005-03-26
CID: 62751

14. DIAZOXON; Oxodiazinon; 962-58-3 ...
MW:     288.279902 g/mol MF: C12H21N2O4P
IUPAC name: diethyl (6-methyl-2-propan-2-ylpyrimidin-4-yl) phosphate
Create Date: 2005-03-27
CID: 13754

15. Coroxon; Coralox; Coumaphos O-analog ...
MW:     346.700002 g/mol MF: C14H16ClO6P
IUPAC name: (3-chloro-4-methyl-2-oxochromen-7-yl) diethyl phosphate
Create Date: 2005-03-27
CID: 9453

16. Ronoxon; Fenchlorphos-oxon; Ronnoxon ...
MW:     305.479482 g/mol MF: C8H8Cl3O4P
IUPAC name: dimethyl (2,4,5-trichlorophenyl) phosphate
Create Date: 2005-03-26
CID: 77602

17. lysine sulfonamide analogue 13c; CHEMBL168640; SCHEMBL757686 ...
MW:     624.790660 g/mol MF: C33H44N4O6S
IUPAC name: methyl N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropy...
Create Date: 2008-01-19
CID: 23644627

18. MALAOXON; Oxycarbophos; Liromat ...
MW:     314.292422 g/mol MF: C10H19O7PS
IUPAC name: diethyl 2-dimethoxyphosphorylsulfanylbutanedioate
Create Date: 2005-03-27
CID: 15415

19. lysine sulfonamide analogue 13b; lysine sulfonamide analogue 13a; BDBM10150 ...
MW:     624.790660 g/mol MF: C33H44N4O6S
IUPAC name: methyl N-[(2R)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropy...
Create Date: 2008-01-19
CID: 23644628

20. L-Cysteine analog; NSC303861; L-Cystein, ethyl ester, methylcarbamate (ester) ...
MW:     242.723600 g/mol MF: C7H15ClN2O3S
IUPAC name: ethyl 2-amino-3-(methylcarbamoylsulfanyl)propanoate;hydrochl...
Create Date: 2005-08-01
CID: 457392

21. Dequalinium analog, C-14 Linker; Dequalinium analog; Dequalinium-14 ...
MW:     766.580660 g/mol MF: C34H48I2N4
IUPAC name: 1-[14-(4-amino-2-methylquinolin-1-ium-1-yl)tetradecyl]-2-met...
Create Date: 2006-10-25
CID: 9853645

22. Balanol analog 21; Balanol analog 20; AC1O3EDI ...
MW:     547.509500 g/mol MF: C29H25NO10
IUPAC name: 2-[2,6-dihydroxy-4-[[(3R)-2-[(4-hydroxybenzoyl)amino]-3-bicy...
Create Date: 2006-01-30
CID: 6326401

23. Balanol analog 23; Balanol analog 22; AC1NS3DH ...
MW:     576.550720 g/mol MF: C30H28N2O10
IUPAC name: 2-[2,6-dihydroxy-4-[[(1R,3S,4S)-4-[(4-hydroxybenzoyl)amino]-...
Create Date: 2006-01-30
CID: 5327924

24. Thieno analogue of kenpaullone; Paullone Analogue 71; BDBM7336 ...
MW:     333.203060 g/mol MF: C14H9BrN2OS
Create Date: 2006-05-10
CID: 6538761

25. Eticyclidine; Cyclohexamine; Cyclohexanamine, N-ethyl-1-phenyl- ...
MW:     203.323240 g/mol MF: C14H21N
IUPAC name: N-ethyl-1-phenylcyclohexan-1-amine
Create Date: 2005-03-26
CID: 16622

26. Ethion dioxon; Ethion oxon; PO-Ethion ...
MW:     352.344904 g/mol MF: C9H22O6P2S2
IUPAC name: 1-[diethoxyphosphorylsulfanylmethylsulfanyl(ethoxy)phosphory...
Create Date: 2005-08-08
CID: 161397

27. 221243-82-9; 1-NA-PP1; pp1 analog ...
MW:     317.387660 g/mol MF: C19H19N5
IUPAC name: 1-tert-butyl-3-naphthalen-1-ylpyrazolo[3,4-d]pyrimidin-4-ami...
Create Date: 2005-03-25
CID: 4877

28. Pirimiphos-ethyl O-analog; UNII-Q7EI95045G; Q7EI95045G ...
MW:     317.321122 g/mol MF: C13H24N3O4P
IUPAC name: [2-(diethylamino)-6-methylpyrimidin-4-yl] diethyl phosphate
Create Date: 2005-03-27
CID: 181476

29. Quinocarmycin analog; DX-52-1; MLS000766289 ...
MW:     357.403620 g/mol MF: C19H23N3O4
Create Date: 2005-03-26
CID: 122737

30. ROLICYCLIDINE; PCPy; 1-(1-Phenylcyclohexyl)pyrrolidine ...
MW:     229.360520 g/mol MF: C16H23N
IUPAC name: 1-(1-phenylcyclohexyl)pyrrolidine
Create Date: 2005-03-27
CID: 62436

31. ASPERGILLIC ACID ANALOG; NSC356436; 2152-59-2 ...
MW:     224.299400 g/mol MF: C12H20N2O2
IUPAC name: 1-hydroxy-3,6-bis(2-methylpropyl)pyrazin-2-one
Create Date: 2006-02-27
CID: 5458821

32. analogue 4; CHEBI:59061; NSC687762 ...
MW:     585.286480 g/mol MF: C24H17Cl4N3O4S
IUPAC name: 2-(2,4-dichloroanilino)-N-[7-[(2,4-dichlorophenyl)sulfamoyl]...
Create Date: 2005-03-26
CID: 390408

33. 2-Hydroxy-4-(methylthio)butyric acid; 583-91-5; Alimet ...
MW:     150.196100 g/mol MF: C5H10O3S
IUPAC name: 2-hydroxy-4-methylsulfanylbutanoic acid
Create Date: 2005-03-26
CID: 11427

34. Vitamin D analog, 16; Vitamin D analog, 12; BDBM93066
MW:     374.599780 g/mol MF: C25H42O2
IUPAC name: (1R,3R)-5-[(2E)-2-[(7aR)-1-[(2R)-hexan-2-yl]-7a-methyl-2,3,3...
Create Date: 2013-05-31
CID: 71463469

35. Vitamin D analog, 14; Vitamin D analog, 10; BDBM93065
MW:     390.599180 g/mol MF: C25H42O3
IUPAC name: (1R,3R)-5-[(2E)-2-[(7aR)-1-[(2R)-6-hydroxyhexan-2-yl]-7a-met...
Create Date: 2013-05-31
CID: 71463468

36. Vitamin D analog, 15; Vitamin D analog, 11; BDBM93062
MW:     390.599180 g/mol MF: C25H42O3
IUPAC name: (1R,3R)-5-[(2E)-2-[(7aR)-1-[(2S)-6-hydroxyhexan-2-yl]-7a-met...
Create Date: 2013-05-31
CID: 71463466

37. GM1 analog; (Gal)2 (GalNAc)1 (Glc)1 (Neu5Ac)1; CHEBI:62675 ...
MW:     998.884180 g/mol MF: C37H62N2O29
IUPAC name: (2S,4S,5R,6R)-5-acetamido-2-[(2R,3S,4R,5R,6S)-3-[(2S,3R,4R,5...
Create Date: 2011-09-16
CID: 53356729

38. GM2 analog; (Gal)1 (GalNAc)1 (Glc)1 (Neu5Ac)1; CHEBI:62676 ...
MW:     836.743580 g/mol MF: C31H52N2O24
IUPAC name: (2S,4S,5R,6R)-5-acetamido-2-[(2R,3S,4R,5R,6S)-3-[(2S,3R,4R,5...
Create Date: 2007-02-09
CID: 14647413

39. Hoechst 33258 analog; 258843-62-8; SCHEMBL14091141 ...
MW:     510.586900 g/mol MF: C29H30N6O3
IUPAC name: 4-[3-[6-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-1H...
Create Date: 2007-02-07
CID: 12116202

40. Vitamin D analog, 17; Vitamin D analog, 13; SCHEMBL14357527 ...
MW:     374.599780 g/mol MF: C25H42O2
IUPAC name: (1R,3R)-5-[(2E)-2-[(7aR)-1-[(2S)-hexan-2-yl]-7a-methyl-2,3,3...
Create Date: 2006-10-26
CID: 11516315

41. Hoechst 33342 analog; 178481-68-0; NCI60_026636 ...
MW:     590.589080 g/mol MF: C32H37Cl2N7
IUPAC name: N,N-bis(2-chloroethyl)-4-[3-[6-[6-(4-methylpiperazin-1-yl)-1...
Create Date: 2005-03-26
CID: 197366

42. ELLIPTICINE ANALOG; 9-HE, HCl; 52238-35-4 ...
MW:     298.766800 g/mol MF: C17H15ClN2O
IUPAC name: 5,11-dimethyl-6H-pyrido[4,3-b]carbazol-9-ol;hydrochloride
Create Date: 2005-08-08
CID: 148569

43. Fenoxon sulfone; Fenthion oxon sulfone; Fenthoxon Sulfone ...
MW:     294.261262 g/mol MF: C10H15O6PS
IUPAC name: dimethyl (3-methyl-4-methylsulfonylphenyl) phosphate
Create Date: 2005-03-27
CID: 26449

44. Benzyl nitrile lidocaine analog; 70121-39-0; 2-(Diethylaminoacetamido)-3-cyano-4-methyl-5-benzylpyrrole hydrochloride ...
MW:     360.881000 g/mol MF: C19H25ClN4O
IUPAC name: N-(5-benzyl-3-cyano-4-methyl-1H-pyrrol-2-yl)-2-(diethylamino...
Create Date: 2005-08-09
CID: 198524

45. GLPG0634 analog; n-(5-(4-((6-cyanopyridin-3-yl)methoxy)phenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropanecarboxamide; SCHEMBL2237596 ...
MW:     410.428020 g/mol MF: C23H18N6O2
IUPAC name: N-[5-[4-[(6-cyanopyridin-3-yl)methoxy]phenyl]-[1,2,4]triazol...
Create Date: 2010-02-08
CID: 44602526

46. Hoechst 33258 analog 5; 23491-55-6; CHEMBL177543 ...
MW:     458.556940 g/mol MF: C29H26N6
IUPAC name: 6-(4-methylpiperazin-1-yl)-2-(2-naphthalen-2-yl-3H-benzimida...
Create Date: 2006-10-25
CID: 10321921

47. Hoechst 33258 analog 3; 23554-98-5; CHEMBL177795 ...
MW:     422.524840 g/mol MF: C26H26N6
IUPAC name: 2-(4-methylphenyl)-6-[6-(4-methylpiperazin-1-yl)-1H-benzimid...
Create Date: 2006-10-25
CID: 10070883

48. Phoxim, oxygen analog; Bayer 10050; Phoxim, O,O-diethyl phosphate ...
MW:     282.232262 g/mol MF: C12H15N2O4P
IUPAC name: [(Z)-[cyano(phenyl)methylidene]amino] diethyl phosphate
Create Date: 2006-10-23
CID: 9562484

49. ANALOGUE A; CHEMBL410852; BDBM50375304 ...
MW:     460.353020 g/mol MF: C23H23Cl2N3O3
IUPAC name: 5-chloro-N-[(2S)-3-(2-chlorophenyl)-1-(4-hydroxypiperidin-1-...
Create Date: 2009-11-19
CID: 44450788

50. benzimidazole analogue, 7e; benzimidazole analogue, 7d; CHEMBL468301 ...
MW:     466.039780 g/mol MF: C22H32ClN5O2S
IUPAC name: methyl N-[4-[[6-chloro-5-(4-ethylpiperazin-1-yl)-1H-benzimid...
Create Date: 2009-08-19
CID: 44143432

51. Dynorphin A (1-13); Analog of Dynorphin A; dynorphin A(1-13) ...
MW:    1603.954740 g/mol MF: C75H126N24O15
IUPAC name: (2S)-6-amino-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-1-[(2S)-2-[[...
Create Date: 2008-12-10
CID: 25075996

52. MITOMYCIN ANALOG; 17287-49-9; [(1as,8s,8ar,8bs)-8a-methoxy-5-methyl-6-morpholin-4-yl-4,7-dioxo-1,1a,2,4,7,8,8a,8b-octahydroazireno[2',3':3,4]pyrrolo[1,2-a]indol-8-yl]methyl carbamate ...
MW:     404.417060 g/mol MF: C19H24N4O6
Create Date: 2005-08-01
CID: 477732

53. Benanserin hydrochloride; Benzyl antiserotonin; Woolley's antiserotonin ...
MW:     330.851720 g/mol MF: C19H23ClN2O
IUPAC name: 2-(1-benzyl-5-methoxy-2-methylindol-3-yl)ethanamine;hydrochl...
Create Date: 2005-07-28
CID: 10670

54. BREQUINAR ANALOG; CHEMBL220467; BRE ...
MW:     357.377043 g/mol MF: C23H16FNO2
IUPAC name: 6-fluoro-3-methyl-2-(4-phenylphenyl)quinoline-4-carboxylic a...
Create Date: 2005-03-25
CID: 1543

55. Sitagliptin Analog 13; SCHEMBL725863; Triazolopiperazine Analogue 25 ...
MW:     389.323156 g/mol MF: C16H16F5N5O
IUPAC name: (3R)-3-amino-4-(2,5-difluorophenyl)-1-[3-(trifluoromethyl)-6...
Create Date: 2006-10-25
CID: 9843297

56. Crixivan analog; 181868-98-4; AC1LABXE ...
MW:     415.524060 g/mol MF: C27H29NO3
IUPAC name: (2R,4S)-2-benzyl-4-hydroxy-N-[(2R)-2-hydroxy-2,3-dihydro-1H-...
Create Date: 2005-08-01
CID: 5480787

57. BI-RG-587 analog; 132932-27-5; 8,N5-Dimethyl-N11-ethyl-5,11-dihydro-6H-pyrido(2,3-b)(1,4)benzodiazepin-6-one ...
MW:     267.325680 g/mol MF: C16H17N3O
IUPAC name: 11-ethyl-5,8-dimethylpyrido[2,3-b][1,4]benzodiazepin-6-one
Create Date: 2005-08-01
CID: 453353

58. Suramin analog; 111129-55-6; 8-[[4-methyl-3-[[4-[[4-[[2-methyl-5-[(4,6,8-trisulfonaphthalen-1-yl)carbamoyl]phenyl]carbamoyl]phenyl]carbamoylamino]benzoyl]amino]benzoyl]amino]naphthalene-1,3,5-trisulfonic acid ...
MW:    1297.279700 g/mol MF: C51H40N6O23S6
IUPAC name: 8-[[4-methyl-3-[[4-[[4-[[2-methyl-5-[(4,6,8-trisulfonaphthal...
Create Date: 2005-08-01
CID: 451871

59. Isoniazid analog; NSC646817; AC1Q5Q61 ...
MW:     342.306160 g/mol MF: C16H14N4O5
IUPAC name: methyl 2-[[2-oxo-2-[2-(pyridine-4-carbonyl)hydrazinyl]acetyl...
Create Date: 2005-03-26
CID: 372001

60. TRIPTOLIDE ANALOG; NSC337783; AC1L7E0S ...
MW:     362.459900 g/mol MF: C21H30O5
IUPAC name: methyl (1aS,1bS,3aR,4R,7aS,9aS)-1b-hydroxy-4,7a-dimethyl-9-o...
Create Date: 2005-03-26
CID: 333793

61. Dicapthoxon; Dicapthon-oxon; Dicapthon oxygen analogue ...
MW:     281.586922 g/mol MF: C8H9ClNO6P
IUPAC name: (2-chloro-4-nitrophenyl) dimethyl phosphate
Create Date: 2005-08-08
CID: 87212

62. 3-Methylxanthine; 1076-22-8; 2,6-Dihydroxy-3-methylpurine ...
MW:     166.137440 g/mol MF: C6H6N4O2
IUPAC name: 3-methyl-7H-purine-2,6-dione
Create Date: 2005-03-26
CID: 70639

63. Chlorpyrifos-methyl; Chloropyriphos-methyl; Trichlormethylfos ...
MW:     322.533142 g/mol MF: C7H7Cl3NO3PS
IUPAC name: dimethoxy-sulfanylidene-(3,5,6-trichloropyridin-2-yl)oxy-$l^...
Create Date: 2005-03-27
CID: 21803

64. Phosphodiester analog, 6(S4A); Phosphodiester analog, 6; BDBM86345
MW:    1213.396642 g/mol MF: C57H97N8O18P
IUPAC name: [(2R,3S)-4-amino-3-[[(2S)-3-hydroxy-2-[[(2S)-2-[[(2S)-2-[[1-...
Create Date: 2012-07-07
CID: 57340569

65. ArylMorpholine Analog 37; AMA37; AM-A37 ...
MW:     283.321780 g/mol MF: C17H17NO3
IUPAC name: (2-hydroxy-4-morpholin-4-ylphenyl)-phenylmethanone
Create Date: 2007-11-13
CID: 16760391

66. Spicamycin analog; NSC650426; KRN5500 ...
MW:     589.683720 g/mol MF: C28H43N7O7
IUPAC name: (2E,4E)-N-[2-[[2-(1,2-dihydroxyethyl)-4,5-dihydroxy-6-(7H-pu...
Create Date: 2005-09-10
CID: 5459220

67. Distamycin analog; NSC645795; 208576-39-0 ...
MW:    1121.115900 g/mol MF: C45H40N10O17S4
IUPAC name: 4-[[4-[[4-[[5-[[5-[(4,8-disulfonaphthalen-1-yl)carbamoyl]-1-...
Create Date: 2005-03-26
CID: 371500

68. methidathion oxygen analog; Methidathion oxon; 39856-16-1 ...
MW:     286.265702 g/mol MF: C6H11N2O5PS2
IUPAC name: 3-(dimethoxyphosphorylsulfanylmethyl)-5-methoxy-1,3,4-thiadi...
Create Date: 2005-03-27
CID: 190999

69. SG-209; Nicorandil Analog; N-[2-(Acetoxy)ethyl]-3-pyridinecarboxamide ...
MW:     208.213880 g/mol MF: C10H12N2O3
IUPAC name: 2-(pyridine-3-carbonylamino)ethyl acetate
Create Date: 2005-03-27
CID: 134230

70. Hoechst 33258 analog 6; 129244-66-2; DTXSID30856158 ...
MW:     536.710300 g/mol MF: C33H40N6O
IUPAC name: 2,6-ditert-butyl-4-[5-[6-(4-methylpiperazin-1-yl)-1H-benzimi...
Create Date: 2013-06-26
CID: 71576675

71. Phosphodiester analog, 4j (S4A); Phosphodiester analog, 4j; BDBM86341
MW:     862.948982 g/mol MF: C40H63N8O11P
IUPAC name: [(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-...
Create Date: 2012-07-07
CID: 57340565

72. Hoechst 33258 analog 2; 23491-54-5; CHEMBL177553 ...
MW:     422.524840 g/mol MF: C26H26N6
IUPAC name: 2-(3-methylphenyl)-6-[6-(4-methylpiperazin-1-yl)-1H-benzimid...
Create Date: 2009-11-19
CID: 44386468

73. flufenamic acid analogue, 41; flufenamic acid analogue, 35; BDBM35908
MW:     319.353880 g/mol MF: C20H17NO3
IUPAC name: 2-(2-phenylmethoxyanilino)benzoic acid
Create Date: 2007-12-05
CID: 20268273

74. Rofecoxib analogue; CHEMBL214101; BDBM50189988 ...
MW:     304.302780 g/mol MF: C17H12N4O2
IUPAC name: 4-phenyl-3-[4-(2H-tetrazol-5-yl)phenyl]-2H-furan-5-one
Create Date: 2007-04-02
CID: 16007065

75. Nucleoside-Analog-1; SCHEMBL14188218; CS-M1995 ...
MW:     267.198260 g/mol MF: C9H9N5O5
IUPAC name: (2R,3S,3aS,9aR)-2-azido-3-hydroxy-2-(hydroxymethyl)-3a,9a-di...
Create Date: 2009-03-16
CID: 25189338

76. Nucleoside-Analog-2; SCHEMBL14188206; CS-M1996 ...
MW:     285.213540 g/mol MF: C9H11N5O6
IUPAC name: 1-[(2R,3S,4S,5R)-5-azido-3,4-dihydroxy-5-(hydroxymethyl)oxol...
Create Date: 2009-03-16
CID: 25185460

77. Streptonigrin hydrazide; Streptonigrin analog; STN-NHNH2 ...
MW:     520.494060 g/mol MF: C25H24N6O7
IUPAC name: (4Z)-5-amino-6-(7-amino-6-methoxy-5,8-dioxoquinolin-2-yl)-4-...
Create Date: 2005-08-01
CID: 5479137

78. Balanol analog 25; Balanol analog 24; AC1NS3DK ...
MW:     576.550720 g/mol MF: C30H28N2O10
IUPAC name: 2-[2,6-dihydroxy-4-[[(3S,4S)-3-[(4-hydroxybenzoyl)amino]-1-a...
Create Date: 2006-01-30
CID: 5327925

79. XL147; 956958-53-5; XL 147 ...
MW:     448.520740 g/mol MF: C21H16N6O2S2
IUPAC name: N-[3-(2,1,3-benzothiadiazol-5-ylamino)quinoxalin-2-yl]-4-met...
Create Date: 2005-07-13
CID: 1893730

80. Griseofulvin Analog A; KBio2_007384; Spectrum_001768 ...
MW:     341.142900 g/mol MF: C15H10Cl2O5
IUPAC name: 4',5-dichloro-3',6-dihydroxy-4,5'-dimethylspiro[1-benzofuran...
Create Date: 2005-09-07
CID: 3334572

81. 1-(1-Phenylcyclohexyl)-4-hydroxypiperidine; 60232-85-1; Phencyclidine-4-hydroxy analog ...
MW:     259.386500 g/mol MF: C17H25NO
IUPAC name: 1-(1-phenylcyclohexyl)piperidin-4-ol
Create Date: 2005-03-26
CID: 98840

82. MGCD-265; 875337-44-3; MGCD 265 ...
MW:     517.597703 g/mol MF: C26H20FN5O2S2
IUPAC name: N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridi...
Create Date: 2008-09-22
CID: 24901704

83. Ecteinascidin-Analog-1; CS-3406; HY-12395 ...
MW:     588.689060 g/mol MF: C31H44N2O9
IUPAC name: tert-butyl (4R)-4-[(1R,3S)-3-(acetyloxymethyl)-7-methoxy-6-m...
Create Date: 2006-10-26
CID: 11642787

84. sulfonamide tricyclic analogue, 9; lysine sulfonamide analogue 9; CHEMBL556453 ...
MW:     526.690720 g/mol MF: C28H38N4O4S
Create Date: 2006-10-26
CID: 11342148

85. Fredericamycin A analog; NSC613532; AC1Q6OLQ ...
MW:     296.274180 g/mol MF: C17H12O5
IUPAC name: 4,4',7'-trihydroxyspiro[1,2-dihydroindene-3,2'-indene]-1',3'...
Create Date: 2005-03-26
CID: 356674

86. AUGUSTINE ANALOG; NSC267430; AC1L81ZZ ...
MW:     287.315320 g/mol MF: C18H13N3O
Create Date: 2005-03-26
CID: 320333

87. Cla-phenyl; 19953-58-3; Cypridina Luciferin analogue ...
MW:     225.245940 g/mol MF: C13H11N3O
IUPAC name: 2-methyl-6-phenyl-7H-imidazo[1,2-a]pyrazin-3-one
Create Date: 2005-09-26
CID: 5158312

88. 145785-62-2; YM1 Doxorubicin analog; YM3 Doxorubicin analog ...
MW:     634.629860 g/mol MF: C33H34N2O11
IUPAC name: 6,9,11-trihydroxy-9-(2-hydroxyacetyl)-7-[5-hydroxy-6-methyl-...
Create Date: 2005-08-09
CID: 196926

89. DMHP; Abbott 40824; delta(sup 3)-Thc ...
MW:     370.568020 g/mol MF: C25H38O2
IUPAC name: 6,6,9-trimethyl-3-(3-methyloctan-2-yl)-7,8,9,10-tetrahydrobe...
Create Date: 2005-03-26
CID: 36276

90. Mebendazole Ethyl Analog; UNII-5A8Z137Y72; Ethyl (5-benzoyl-1H-benzimidazol-2-yl)carbamate ...
MW:     309.319300 g/mol MF: C17H15N3O3
IUPAC name: ethyl N-(6-benzoyl-1H-benzimidazol-2-yl)carbamate
Create Date: 2011-11-21
CID: 53492891

91. 128322-44-1; MCLA; 6-(4-Methoxyphenyl)-2-methylimidazo[1,2-a]pyrazin-3(7H)-one hydrochloride ...
MW:     291.732860 g/mol MF: C14H14ClN3O2
IUPAC name: 6-(4-methoxyphenyl)-2-methyl-7H-imidazo[1,2-a]pyrazin-3-one;...
Create Date: 2007-07-16
CID: 16218650

92. PRADIMICIN ANALOG; 148676-99-7; D-Phenylalanine, N-((5-((4,6-dideoxy-4-(methylamino)-3-O-beta-D-xylopyranosyl-beta-D-galactopyranosyl)oxy)-5,6,8,13-tetrahydro-1,6,9,14-tetrahydroxy-11-methoxy-3-methyl-8,13-dioxobenzo(a)naphthacen-2-yl)carbonyl)-, (5S-trans)- ...
MW:     916.875920 g/mol MF: C46H48N2O18
IUPAC name: (2R)-3-phenyl-2-[[(5S,6S)-1,6,9,14-tetrahydroxy-5-[(2S,3R,4S...
Create Date: 2005-08-01
CID: 461670

93. NSC640065; ADAM analog; Alkenyldiarylmethane analog ...
MW:     584.294220 g/mol MF: C25H28Br2O6
IUPAC name: methyl 3-bromo-5-[1-(3-bromo-4-methoxy-5-methoxycarbonylphen...
Create Date: 2005-03-26
CID: 368798

94. Mitomycin C analog; NSC365354; AC1L7PNB ...
MW:     388.417660 g/mol MF: C19H24N4O5
Create Date: 2005-03-26
CID: 339291

95. Aminosumithion; AMINOFENITROTHION; 4-Aminofenitrothion ...
MW:     247.251122 g/mol MF: C9H14NO3PS
IUPAC name: 4-dimethoxyphosphinothioyloxy-2-methylaniline
Create Date: 2005-08-08
CID: 25843

96. Vardenafil Acetyl Analogue; UNII-12CRG74917; 12CRG74917 ...
MW:     466.575860 g/mol MF: C25H34N6O3
IUPAC name: 2-[2-ethoxy-5-[2-(4-ethylpiperazin-1-yl)acetyl]phenyl]-5-met...
Create Date: 2013-11-01
CID: 71752929

97. WEHI-345 (analog); SCHEMBL727021; CS-5569 ...
MW:     415.490900 g/mol MF: C23H25N7O
IUPAC name: N-[2-[4-amino-3-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-1-y...
Create Date: 2012-02-13
CID: 56602558

98. NMS-P715 (analog); CHEMBL1808340; SCHEMBL1559206 ...
MW:     622.759780 g/mol MF: C35H42N8O3
IUPAC name: N-(2,6-diethylphenyl)-8-[2-methoxy-4-[(1-methylpiperidin-4-y...
Create Date: 2010-01-25
CID: 44556163

99. Azodrin,cis; Monocrotophos (Z)-analog; Dimethyl (Z)-1-methyl-3-(methylamino)-3-oxoprop-1-enyl phosphate ...
MW:     223.163522 g/mol MF: C7H14NO5P
IUPAC name: dimethyl [(Z)-4-(methylamino)-4-oxobut-2-en-2-yl] phosphate
Create Date: 2005-03-27
CID: 5371558

100. Disulfide benzamide analog; DIBA-2; 171744-40-4 ...
MW:     698.809440 g/mol MF: C30H26N4O8S4
IUPAC name: N-[4-(acetylsulfamoyl)phenyl]-2-[[2-[[4-(acetylsulfamoyl)phe...
Create Date: 2005-08-01
CID: 462932

101. BALANOL ANALOG 1; B1L; 3-[(4-HYDROXYBENZOYL)AMINO]AZEPAN-4-YL 4-HYDROXYBENZOATE ...
MW:     370.399080 g/mol MF: C20H22N2O5
IUPAC name: [(3R,4R)-3-[(4-hydroxybenzoyl)amino]azepan-4-yl] 4-hydroxybe...
Create Date: 2005-06-24
CID: 448326

102. N,N-Diethyl-3-methylbenzamide; DEET; N,N-Diethyl-m-toluamide ...
MW:     191.269480 g/mol MF: C12H17NO
IUPAC name: N,N-diethyl-3-methylbenzamide
Create Date: 2005-03-25
CID: 4284

103. ONO-4059 (analog); GTPL9265; SCHEMBL14798147 ...
MW:     456.496460 g/mol MF: C25H24N6O3
IUPAC name: 6-amino-7-(4-phenoxyphenyl)-9-[(3S)-1-prop-2-enoylpiperidin-...
Create Date: 2015-02-13
CID: 89455219

104. Arry-380; 937265-83-3; Arry380 ...
MW:     569.634180 g/mol MF: C29H27N7O4S
IUPAC name: 6-[5-[(2-methylsulfonylethylamino)methyl]furan-2-yl]-N-[3-me...
Create Date: 2009-06-01
CID: 42598643

105. CHEMBL332551; 724708-21-8; Hymenialdisine Analogue 1 ...
MW:     295.296020 g/mol MF: C15H13N5O2
IUPAC name: (5Z)-5-(2-amino-4-oxo-1H-imidazol-5-ylidene)-2,3,4,10-tetrah...
Create Date: 2006-10-25
CID: 9882612

106. PNU-104489; Alkylamino-piperidine analog; U 104489 ...
MW:     512.667440 g/mol MF: C26H36N6O3S
IUPAC name: N-[2-[4-[[3-(tert-butylamino)pyridin-2-yl]-ethylamino]piperi...
Create Date: 2005-08-01
CID: 462966

107. N-(4-Hydroxy-3-methyl-1-naphthyl)acetamide; 523-68-2; Vitamin K5 N-acetyl analog ...
MW:     215.247820 g/mol MF: C13H13NO2
IUPAC name: N-(4-hydroxy-3-methylnaphthalen-1-yl)acetamide
Create Date: 2005-08-08
CID: 124103

108. Fluspirilene; Redeptin; Imap ...
MW:     475.572746 g/mol MF: C29H31F2N3O
IUPAC name: 8-[4,4-bis(4-fluorophenyl)butyl]-1-phenyl-1,3,8-triazaspiro[...
Create Date: 2005-03-25
CID: 3396

109. 10-Propargyl-5-methyl-5-deazaaminopterin analog of folic acid; 135423-85-7; 10-Pmdap ...
MW:     491.499200 g/mol MF: C24H25N7O5
IUPAC name: (2S)-2-[[4-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl...
Create Date: 2005-08-08
CID: 131879

110. Olaparib; 763113-22-0; AZD2281 ...
MW:     434.462823 g/mol MF: C24H23FN4O3
IUPAC name: 4-[[3-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]-4-fluo...
Create Date: 2008-02-11
CID: 23725625

111. P-F-HHSiD hydrochloride; p-Fluorohexahydro-sila-difenidol hydrochloride; Hexahydro-sila-difenidol hydrochloride, p-fluoro analog ...
MW:     386.019023 g/mol MF: C20H33ClFNOSi
IUPAC name: cyclohexyl-(4-fluorophenyl)-hydroxy-(3-piperidin-1-ylpropyl)...
Create Date: 2006-12-01
CID: 11957564

112. DACP analog of retinoic acid; Ro 8-7699; AC1O5P47 ...
MW:     314.418640 g/mol MF: C20H26O3
IUPAC name: (2E,4E,6E,8E)-9-(2-acetyl-5,5-dimethylcyclopenten-1-yl)-3,7-...
Create Date: 2006-04-28
CID: 6438146

113. Hoechst 33342 analog 2; Iodohoechst 33258; AC1NUP86 ...
MW:     550.394190 g/mol MF: C25H23IN6O
IUPAC name: (4E)-2-iodo-4-[5-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol...
Create Date: 2005-08-08
CID: 5487193

114. NBD FGIN-1-27 Analog; AC1MBZ3I; CTK8G1642 ...
MW:     512.559720 g/mol MF: C28H28N6O4
IUPAC name: N-[6-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]hexyl]-2-(2-ph...
Create Date: 2005-07-19
CID: 2733523

115. L289612 analog; D-Cysteine Analog 17f; AC1LA5TL ...
MW:     614.775920 g/mol MF: C30H38N4O6S2
IUPAC name: N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-[[(2S)-2-(methanesulfona...
Create Date: 2005-08-01
CID: 462298

116. methanol; methyl alcohol; wood alcohol ...
MW:      32.041860 g/mol MF: CH4O
IUPAC name: methanol
Create Date: 2004-09-16
CID: 887

117. AR-13324 (mesylate analog); CS-5190; HY-19346
MW:     631.717020 g/mol MF: C29H33N3O9S2
IUPAC name: [4-[(2S)-3-amino-1-(isoquinolin-6-ylamino)-1-oxopropan-2-yl]...
Create Date: 2016-03-02
CID: 118704755

118. Macitentan (n-butyl analogue); CHEMBL2163694; BDBM50395617 ...
MW:     587.284840 g/mol MF: C20H21Br2N5O4S
IUPAC name: N-[5-(4-bromophenyl)-6-[2-(5-bromopyrimidin-2-yl)oxyethoxy]p...
Create Date: 2013-05-30
CID: 71449713

119. alpha-ketothiazole analogue 36; CHEMBL273653; GTPL6549 ...
MW:     723.684720 g/mol MF: C29H43BrN10O5S
IUPAC name: (2S)-2-[[(1R)-1-(4-bromophenyl)ethyl]carbamoylamino]-5-(carb...
Create Date: 2007-06-18
CID: 16098914

120. ISOTHIAZOLIDINONE ANALOG; CHEMBL382311; IZD ...
MW:     486.540740 g/mol MF: C23H26N4O6S
IUPAC name: (2S)-2-acetamido-N-[(2S)-1-amino-1-oxo-3-[4-[(5S)-1,1,3-trio...
Create Date: 2006-09-12
CID: 9547915

121. Quassinoid analog; NSC608504
MW:     474.586420 g/mol MF: C27H38O7
Create Date: 2006-02-27
CID: 5459060

122. Quassinoid analog; NSC608504; NSC-608504
MW:     474.586420 g/mol MF: C27H38O7
Create Date: 2005-03-26
CID: 5386369

123. 2,2'-Dithiobisbenzamide analog; 3-[(3-carbamoylphenyl)disulfanyl]benzamide; NSC608549 ...
MW:     304.387280 g/mol MF: C14H12N2O2S2
IUPAC name: 3-[(3-carbamoylphenyl)disulfanyl]benzamide
Create Date: 2005-03-26
CID: 355240

124. NSC 601980 (analog); NSC601980; AC1L72HG ...
MW:     250.298460 g/mol MF: C15H14N4
IUPAC name: 1-(3-methylquinoxalin-2-yl)-2-phenylhydrazine
Create Date: 2005-03-26
CID: 353494

125. compound 56; N-(3-bromophenyl)-6,7-diethoxyquinazolin-4-amine; 4-[(3-Bromophenyl)amino]-6,7-diethoxyquinazoline ...
MW:     388.258420 g/mol MF: C18H18BrN3O2
IUPAC name: N-(3-bromophenyl)-6,7-diethoxyquinazolin-4-amine
Create Date: 2005-03-25
CID: 2857

126. 10-Propargyl-5-deazaaminopterin analog of folic acid; 10-Pdapt; AC1L2ZYW ...
MW:     477.472620 g/mol MF: C23H23N7O5
IUPAC name: (2S)-2-[[4-[(2,4-diaminopyrido[2,3-d]pyrimidin-6-yl)methyl-p...
Create Date: 2005-08-08
CID: 131878

127. dicumarol; dicoumarol; Bishydroxycoumarin ...
MW:     336.294980 g/mol MF: C19H12O6
IUPAC name: 4-hydroxy-3-[(4-hydroxy-2-oxochromen-3-yl)methyl]chromen-2-o...
Create Date: 2011-12-26
CID: 54676038

128. JWH 018 6-methoxyindole analog; LQWPINYSBSBWIN-UHFFFAOYSA-N; ZINC64859460 ...
MW:     371.471500 g/mol MF: C25H25NO2
IUPAC name: (6-methoxy-1-pentylindol-3-yl)-naphthalen-1-ylmethanone
Create Date: 2011-10-30
CID: 53394753

129. CHEMBL16925; 2,4,5-Triarylimidazole analogue; SCHEMBL5137478 ...
MW:     417.435603 g/mol MF: C23H20FN5O2
IUPAC name: 1-[1-[4-[4-(4-fluorophenyl)-5-pyridin-4-yl-1H-imidazol-2-yl]...
Create Date: 2007-12-04
CID: 18771543

130. CHEMBL87588; SB-203580 analogue (4); SCHEMBL2648930 ...
MW:     394.239723 g/mol MF: C20H13BrFN3
IUPAC name: 4-[2-(4-bromophenyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl]pyr...
Create Date: 2006-10-25
CID: 9952509

131. CHEMBL432882; hydroxamate analogue 22; AC1O6ZZW ...
MW:     364.416100 g/mol MF: C17H20N2O5S
IUPAC name: (2R)-N-hydroxy-3-methyl-2-[(4-phenoxyphenyl)sulfonylamino]bu...
Create Date: 2006-05-10
CID: 6539670

132. 172505-89-4; Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-(2-ethoxy-6-fluorophenyl)ethyl)-; PETT Analog 60 ...
MW:     398.293083 g/mol MF: C16H17BrFN3OS
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-(2-ethoxy-6-fluorophenyl)ethyl]...
Create Date: 2005-08-01
CID: 3001125

133. Mag-indo-1 tetrapotassium salt; Mag-Indo 1; 132299-21-9 ...
MW:     594.737060 g/mol MF: C21H14K4N2O9
IUPAC name: tetrapotassium;2-[4-[bis(carboxylatomethyl)amino]-3-(carboxy...
Create Date: 2005-07-19
CID: 2762664

134. IsoquinCON Thf-Thp Urethane analog; AC1LA3FU; CHEMBL113233 ...
MW:     571.747960 g/mol MF: C32H49N3O6
IUPAC name: [(3S,3aR,7aS)-3,3a,4,5,6,7a-hexahydro-2H-furo[2,3-b]pyran-3-...
Create Date: 2005-08-01
CID: 461021

135. IsoquinCON Thf-Thp Urethane analog; AC1LA3FR; CHEMBL264397 ...
MW:     571.747960 g/mol MF: C32H49N3O6
IUPAC name: [(3R,3aS,7aR)-3,3a,4,5,6,7a-hexahydro-2H-furo[2,3-b]pyran-3-...
Create Date: 2005-08-01
CID: 461020

136. NSC642309; Colchicine analog; AC1L800J ...
MW:     483.490440 g/mol MF: C24H21NO8S
IUPAC name: 3,4,5-trihydroxy-N-(1,2,3-trihydroxy-10-methylsulfanyl-9-oxo...
Create Date: 2005-03-26
CID: 369942

137. Methylsystox sulfone; Demeton-O-methyl sulfone; Disulfoton oxygen analog sulfone ...
MW:     262.284062 g/mol MF: C6H15O5PS2
IUPAC name: 2-ethylsulfonylethoxy-dimethoxy-sulfanylidene-$l^{5}-phospha...
Create Date: 2005-08-08
CID: 117524

138. mesoridazine; Serentil; Lidanar ...
MW:     386.573940 g/mol MF: C21H26N2OS2
IUPAC name: 10-[2-(1-methylpiperidin-2-yl)ethyl]-2-methylsulfinylphenoth...
Create Date: 2005-03-25
CID: 4078

139. 1132650-67-9; Lisinopril Cyclohexyl Analog; UNII-FJ10AC5C13 ...
MW:     411.535580 g/mol MF: C21H37N3O5
IUPAC name: (2S)-1-[(2S)-6-amino-2-[[(1S)-1-carboxy-3-cyclohexylpropyl]a...
Create Date: 2013-07-08
CID: 71587933

140. Mitomycin C analog; AC1L9XJC; 4349-74-0 ...
MW:     388.417660 g/mol MF: C19H24N4O5
Create Date: 2005-08-01
CID: 457970

141. D4A pyran analog; 9-[(2R,6R)-6-ethyl-3,6-dihydro-2H-pyran-2-yl]purin-6-amine; AC1L9RIQ ...
MW:     245.280400 g/mol MF: C12H15N5O
IUPAC name: 9-[(2R,6R)-6-ethyl-3,6-dihydro-2H-pyran-2-yl]purin-6-amine
Create Date: 2005-08-01
CID: 454272

142. D4A pyran analog; 9-[(2S,6R)-6-ethyl-3,6-dihydro-2H-pyran-2-yl]purin-6-amine; AC1L9RIP ...
MW:     245.280400 g/mol MF: C12H15N5O
IUPAC name: 9-[(2S,6R)-6-ethyl-3,6-dihydro-2H-pyran-2-yl]purin-6-amine
Create Date: 2005-08-01
CID: 454271

143. Rebeccamycin analog; NSC640199; 1,11-dichloro-6-[2-(diethylamino)ethyl]-12-(4-o-methylhexopyranosyl)-12,13-dihydro-5h-indolo[2,3-a]pyrrolo[3,4-c]carbazole-5,7(6h)-dione ...
MW:     669.551660 g/mol MF: C33H34Cl2N4O7
Create Date: 2005-03-26
CID: 368860

144. 6-methoxyquinoline-5,8-dione; 54232-20-1; AQEXJGOBLPCFIF-UHFFFAOYSA-N ...
MW:     189.167480 g/mol MF: C10H7NO3
IUPAC name: 6-methoxyquinoline-5,8-dione
Create Date: 2005-03-26
CID: 253686

145. Irinotecan hydrochloride; 100286-90-6; Topotecin ...
MW:     623.138960 g/mol MF: C33H39ClN4O6
Create Date: 2005-06-24
CID: 74990

146. TCMDC-131928; GW1843; BW 1843U89 ...
MW:     500.502660 g/mol MF: C27H24N4O6
IUPAC name: (2S)-2-[6-[(3-methyl-1-oxo-4H-benzo[f]quinazolin-9-yl)methyl...
Create Date: 2005-06-24
CID: 60863

147. Pimelic Diphenylamide 106 (analog); CS-5253; HY-19430
MW:     353.457980 g/mol MF: C21H27N3O2
IUPAC name: N'-(2-aminophenyl)-N-(4-methylphenyl)octanediamide
Create Date: 2016-03-02
CID: 118704757

148. CHEMBL365585; K-252a analogue; BDBM50167983 ...
MW:     455.505100 g/mol MF: C27H25N3O4
Create Date: 2009-11-19
CID: 44400503

149. CHEMBL370493; K-252a analogue; BDBM50167984 ...
MW:     455.505100 g/mol MF: C27H25N3O4
Create Date: 2009-11-19
CID: 44400432

150. Fura 2 magnesium-selective analog tetrapotassium salt; Furaptra Tetrapotassium Salt; 132319-57-4 ...
MW:     473.408860 g/mol MF: C18H14KN2O11
IUPAC name: 2-[6-[bis(carboxymethyl)amino]-5-(carboxymethoxy)-1-benzofur...
Create Date: 2007-07-16
CID: 16219362

151. Chlorohaloperidol; 59995-68-5; CHEMBL363548 ...
MW:     392.318820 g/mol MF: C21H23Cl2NO2
IUPAC name: 1-(4-chlorophenyl)-4-[4-(4-chlorophenyl)-4-hydroxypiperidin-...
Create Date: 2005-08-09
CID: 173712

152. alphamethylacetylfentanyl; Acetyl-alpha-methylfentanyl; 101860-00-8 ...
MW:     336.470520 g/mol MF: C22H28N2O
IUPAC name: N-phenyl-N-[1-(1-phenylpropan-2-yl)piperidin-4-yl]acetamide
Create Date: 2005-03-27
CID: 62307

153. Quinapril analogue; BDBM50286396; tributyl[(4-{2-[(2S)-2-{[(1E)-(cyclohexylamino)(cyclohexyliminiumyl)methyl]amino}-4-phenylbutanoyl]-1,2,3,4-tetrahydroisoquinoline-3-amido}phenyl)methyl]phosphanium dichloride
MW:     836.181782 g/mol MF: C52H78N5O2P+2
IUPAC name: cyclohexyl-[(cyclohexylamino)-[[(2S)-1-oxo-4-phenyl-1-[3-[[4...
Create Date: 2015-10-14
CID: 91934860

154. NSC81052; STREPTONIGRIN ANALOG (MEO-N3); 14097-33-7 ...
MW:     230.179640 g/mol MF: C10H6N4O3
IUPAC name: 7-azido-6-methoxyquinoline-5,8-dione
Create Date: 2005-08-01
CID: 494043

155. L-alanyl UPOC analog; 93806-72-5; AC1L9V2N ...
MW:     358.304020 g/mol MF: C13H18N4O8
IUPAC name: 2-(2-aminopropanoylamino)-2-[(2R,3S,4R,5R)-5-(2,4-dioxopyrim...
Create Date: 2005-08-01
CID: 456523

156. ELLIPTICINE ANALOG JR6-387-B; NSC361830; AC1Q4YVG ...
MW:     330.465940 g/mol MF: C23H26N2
IUPAC name: 11-butyl-5-methyl-6-propylpyrido[4,3-b]carbazole
Create Date: 2005-03-26
CID: 338639

157. ELLIPTICINE ANALOG JR6-390-A; NSC361803; AC1L7O86 ...
MW:     304.385600 g/mol MF: C20H20N2O
IUPAC name: 5,11-dimethyl-2-oxido-6-propylpyrido[4,3-b]carbazol-2-ium
Create Date: 2005-03-26
CID: 338624

158. ELLIPTICINE ANALOG JR6-376-1; NSC361801; AC1L7O83 ...
MW:     304.342540 g/mol MF: C19H16N2O2
IUPAC name: 1-(5,11-dimethyl-2-oxidopyrido[4,3-b]carbazol-2-ium-6-yl)eth...
Create Date: 2005-03-26
CID: 338622

159. ELLIPTICINE ANALOG JR6-367-1; NSC361800; AC1Q4YVF ...
MW:     288.386200 g/mol MF: C20H20N2
IUPAC name: 5,11-dimethyl-6-propylpyrido[4,3-b]carbazole
Create Date: 2005-03-26
CID: 338621

160. ELLIPTICINE ANALOG JR6-361-1; NSC361799; AC1L7O7X ...
MW:     288.343140 g/mol MF: C19H16N2O
IUPAC name: 1-(5,11-dimethylpyrido[4,3-b]carbazol-6-yl)ethanone
Create Date: 2005-03-26
CID: 338620

161. 7-Amino-6-methoxy-5,8-quinolinedione; 14151-19-0; NSC76890 ...
MW:     204.182120 g/mol MF: C10H8N2O3
IUPAC name: 7-amino-6-methoxyquinoline-5,8-dione
Create Date: 2005-03-26
CID: 253693

162. Acibenzolar-S-Methyl; Actigard; Bendicar ...
MW:     210.276040 g/mol MF: C8H6N2OS2
IUPAC name: S-methyl 1,2,3-benzothiadiazole-7-carbothioate
Create Date: 2005-08-08
CID: 86412

163. Quinapril analogue; CHEMBL1162799; DNC004292
MW:     908.095722 g/mol MF: C52H79Cl2N5O2P+
IUPAC name: tributyl-[[4-[[2-[(2S)-2-[(N,N'-dicyclohexylcarbamimidoyl)am...
Create Date: 2010-10-06
CID: 46905896

164. Benazeprilat Benzyl Ester Analogue, Trifluoroacetic Acid Salt; 1356578-34-1; CTK8F7946 ...
MW:     600.582250 g/mol MF: C31H31F3N2O7
IUPAC name: 2-[(3S)-2-oxo-3-[[(2S)-1-oxo-4-phenyl-1-phenylmethoxybutan-2...
Create Date: 2010-07-26
CID: 46780635

165. Cdk/Crk Inhibitor; RGB-286147; Pyrazolopyrimidone analog, RGB-286147 ...
MW:     473.351780 g/mol MF: C23H22Cl2N4O3
IUPAC name: 1-(2,6-dichlorophenyl)-6-[[4-(2-hydroxyethoxy)phenyl]methyl]...
Create Date: 2006-10-20
CID: 9549301

166. 4-Thionucleoside analog; AC1LANHT; SCHEMBL9115366 ...
MW:     285.753180 g/mol MF: C10H12ClN5OS
IUPAC name: [(2R,5S)-5-(6-amino-2-chloropurin-9-yl)thiolan-2-yl]methanol
Create Date: 2005-08-01
CID: 491669

167. 4-Thionucleoside analog; AC1LA79C; CTK7J7127 ...
MW:     285.753180 g/mol MF: C10H12ClN5OS
IUPAC name: [(2S,5R)-5-(6-amino-2-chloropurin-9-yl)thiolan-2-yl]methanol
Create Date: 2005-08-01
CID: 482781

168. 93806-79-2; L-alanyl UPOC analog; 1-(5'-(L-Alanylamino)-5'-deoxy-alpha-L-talofuranosyluronic acid)uracil ...
MW:     358.304020 g/mol MF: C13H18N4O8
IUPAC name: (2R)-2-[[(2S)-2-aminopropanoyl]amino]-2-[(2R,3S,4R,5R)-5-(2,...
Create Date: 2005-08-01
CID: 456526

169. 7605-48-3; NSC158727; NSC-158727 ...
MW:     330.550440 g/mol MF: C20H26S2
IUPAC name: 1-tert-butyl-4-[(4-tert-butylphenyl)disulfanyl]benzene
Create Date: 2005-03-26
CID: 292755

170. 4857-44-7; Calcium 2-hydroxy-4-(methylthio)butanoate; calcium hydroxymethionine ...
MW:     338.454320 g/mol MF: C10H18CaO6S2
IUPAC name: calcium;2-hydroxy-4-methylsulfanylbutanoate
Create Date: 2005-08-08
CID: 107344

171. Deaminocozymase; Desamino-DPN; Deamino-NAD ...
MW:     665.417804 g/mol MF: C21H27N6O15P2+
IUPAC name: [[5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl...
Create Date: 2005-03-25
CID: 4481

172. Hymenialdisine Analogue 1; 693222-51-4; CTK8E9485 ...
MW:     295.296020 g/mol MF: C15H13N5O2
IUPAC name: 5-(2-amino-4-oxo-1H-imidazol-5-ylidene)-2,3,4,10-tetrahydroa...
Create Date: 2009-05-27
CID: 25809075

173. 6-AMINO-1-BENZYL-5-METHYLAMINOURACIL; 72816-88-7; MLS000564217 ...
MW:     246.265160 g/mol MF: C12H14N4O2
IUPAC name: 6-amino-1-benzyl-5-(methylamino)pyrimidine-2,4-dione
Create Date: 2005-07-08
CID: 726225

174. L-citrullyl UPOC analog; 93806-81-6; 1-(5'-(L-Citrullyamino)-5'-deoxy-alpha-L-talofuranosyluronic acid)uracil ...
MW:     444.396560 g/mol MF: C16H24N6O9
IUPAC name: (2R)-2-[[(2S)-2-amino-5-(carbamoylamino)pentanoyl]amino]-2-[...
Create Date: 2005-08-01
CID: 456527

175. L-citrullyl UPOC analog; 86632-65-7; AC1L9V22 ...
MW:     444.396560 g/mol MF: C16H24N6O9
IUPAC name: (2S)-2-[[(2S)-2-amino-5-(carbamoylamino)pentanoyl]amino]-2-[...
Create Date: 2005-08-01
CID: 456516

176. ACTINOMYCIN ANALOG; NSC 266102; AC1L3SOB ...
MW:     728.746160 g/mol MF: C34H44N6O12
IUPAC name: (2S)-2-[[2-[[1-[8-amino-9-[1-[[2-[[(1S)-1-carboxy-2-methylpr...
Create Date: 2005-08-08
CID: 146168

177. 3-methoxy-n,n,n-trimethyl-3-oxopropan-1-aminium bromide; Reversed carboxyl" analogue of acetylcholine; Methyl(beta-trimethylammonium)propionate bromide ...
MW:     226.111440 g/mol MF: C7H16BrNO2
IUPAC name: (3-methoxy-3-oxopropyl)-trimethylazanium;bromide
Create Date: 2005-08-08
CID: 84330

178. benzimidazole analogue, 7h; CHEMBL467057; BDBM29988
MW:     464.066960 g/mol MF: C23H34ClN5OS
IUPAC name: N-[4-[[6-chloro-5-(4-ethylpiperazin-1-yl)-1H-benzimidazol-2-...
Create Date: 2009-08-19
CID: 44143433

179. CHEMBL501480; Macrocyclic 3-Aminopyrrolidinone analog 26B; BDBM14001 ...
MW:     475.541100 g/mol MF: C29H25N5O2
Create Date: 2008-01-19
CID: 23646575

180. CHEMBL498042; Macrocyclic 3-Aminopyrrolidinone analog 36B; BDBM14005 ...
MW:     413.471720 g/mol MF: C24H23N5O2
Create Date: 2006-10-26
CID: 10971692

181. CHEMBL525413; Macrocyclic 3-Aminopyrrolidinone analog 27B; BDBM14003 ...
MW:     509.986160 g/mol MF: C29H24ClN5O2
Create Date: 2006-10-25
CID: 9983801

182. 5'-Noraristeromycin analog; 5'-Mercapto-5'-deoxy-5'-noraristeromycin; AC1LAOAG ...
MW:     269.280340 g/mol MF: C9H11N5O3S
IUPAC name: (2S,3S,4R,5S)-2-(6-aminopurin-9-yl)-5-sulfanyloxolane-3,4-di...
Create Date: 2005-08-01
CID: 492117

183. 5'-Noraristeromycin analog; 5'-Mercapto-5'-deoxy-5'-noraristeromycin; AC1LAOAD ...
MW:     269.280340 g/mol MF: C9H11N5O3S
IUPAC name: (2R,3R,4S,5R)-2-(6-aminopurin-9-yl)-5-sulfanyloxolane-3,4-di...
Create Date: 2005-08-01
CID: 492116

184. Fenitrooxon-d6; Oxo-Sumithion; 3-Methyldimethylparaoxon ...
MW:     267.205413 g/mol MF: C9H12NO6P
IUPAC name: (3-methyl-4-nitrophenyl) bis(trideuteriomethyl) phosphate
Create Date: 2010-03-29
CID: 45039248

185. BMS-387032 analog 27; AC1NS7XZ; CHEMBL49618 ...
MW:     394.554640 g/mol MF: C18H26N4O2S2
IUPAC name: 4-amino-N-[5-[(5-tert-butyl-1,3-oxazol-2-yl)methylsulfanyl]-...
Create Date: 2006-01-30
CID: 5329927

186. carbocyclic analogue 9; AC1LARQG; Carbocyclic Analogue 51 ...
MW:     290.314420 g/mol MF: C15H18N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-phenoxycyclohexene-1-carbox...
Create Date: 2005-08-01
CID: 493864

187. carbocyclic analogue 8; AC1LARQD; Carbocyclic Analogue 48 ...
MW:     296.362060 g/mol MF: C15H24N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-cyclohexyloxycyclohexene-1-...
Create Date: 2005-08-01
CID: 493861

188. Carbocyclic Analogue 3; Carbocyclic Analogue 34; CHEMBL54758 ...
MW:     256.298200 g/mol MF: C12H20N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-propoxycyclohexene-1-carbox...
Create Date: 2005-08-01
CID: 480258

189. 129779-68-6; Ac.b.Pyranoid analog of AZT; AC1L9Q4W ...
MW:     323.304580 g/mol MF: C13H17N5O5
IUPAC name: [(2S,4S,6R)-4-azido-6-(5-methyl-2,4-dioxopyrimidin-1-yl)oxan...
Create Date: 2005-08-01
CID: 452177

190. NSC 355457; 96705-56-5; 9-hydroxy-2,3,8-trimethoxy-6-methyl-11h-indeno[1,2-c]isoquinolinium chloride ...
MW:     373.830100 g/mol MF: C20H20ClNO4
IUPAC name: 2,3,8-trimethoxy-6-methyl-11H-indeno[1,2-c]isoquinolin-6-ium...
Create Date: 2005-08-08
CID: 130333

191. Fonofos oxon; (R)-Fonofos oxon; (S)-Fonofos oxon ...
MW:     230.263662 g/mol MF: C10H15O2PS
IUPAC name: [ethoxy(ethyl)phosphoryl]sulfanylbenzene
Create Date: 2005-03-27
CID: 13675

192. CHEMBL55921; carbocyclic analogue 18; Carbocyclic Analogue 59 ...
MW:     298.338180 g/mol MF: C13H22N4O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-(diaminomethylideneamino)-3-propoxy...
Create Date: 2005-08-01
CID: 493872

193. Alyylamino-piperidine analog; AC1LA78Z; BDBM1958 ...
MW:     510.651560 g/mol MF: C26H34N6O3S
IUPAC name: N-[2-[4-[cyclopropyl-[3-(propan-2-ylamino)pyridin-2-yl]amino...
Create Date: 2005-08-01
CID: 462965

194. ANALOGUE OF INDINAVIR DRUG; DB01721
MW:     670.837500 g/mol MF: C39H50N4O6
IUPAC name: (2R)-4-(1,3-benzodioxol-5-ylmethyl)-N-tert-butyl-1-[(2R,4R,5...
Create Date: 2010-11-09
CID: 46936200

195. PT-104; 149488-13-1; Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-(2,6-difluorophenyl)ethyl)- ...
MW:     372.230986 g/mol MF: C14H12BrF2N3S
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-(2,6-difluorophenyl)ethyl]thiou...
Create Date: 2005-08-01
CID: 3001078

196. PSTQ Analog, 3{1,43}; ChemDiv3_008421; AC1M23UC ...
MW:     429.494260 g/mol MF: C23H19N5O2S
IUPAC name: 3-(benzenesulfonyl)-N-benzyl-N-methyltriazolo[1,5-a]quinazol...
Create Date: 2005-07-14
CID: 2136426

197. MLS000766263; NSC606985; SMR000528863 ...
MW:     441.864300 g/mol MF: C22H20ClN3O5
Create Date: 2005-03-26
CID: 354677

198. Folate Analog 1843u89; 1843U89
MW:     498.486780 g/mol MF: C27H22N4O6-2
IUPAC name: (2S)-2-[6-[(3-methyl-1-oxo-4H-benzo[f]quinazolin-9-yl)methyl...
Create Date: 2010-10-25
CID: 46926167

199. Baricitinib (phosphate); 1187595-84-1; INCB424-ANALOGUE ...
MW:     469.412062 g/mol MF: C16H20N7O6PS
IUPAC name: 2-[1-ethylsulfonyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyr...
Create Date: 2009-10-19
CID: 44231848

200. Baricitinib; 1187594-09-7; INCB-028050 ...
MW:     371.416880 g/mol MF: C16H17N7O2S
IUPAC name: 2-[1-ethylsulfonyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyr...
Create Date: 2009-09-28
CID: 44205240

201. BAY 59-7939 Analog 18; SCHEMBL78030; BDBM7841 ...
MW:     415.462840 g/mol MF: C20H21N3O5S
IUPAC name: 5-methyl-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,...
Create Date: 2006-10-26
CID: 11711363

202. BAY 59-7939 Analog 15; SCHEMBL77202; BDBM7632 ...
MW:     435.924380 g/mol MF: C20H22ClN3O4S
IUPAC name: 5-chloro-N-[[(5S)-3-(2-methyl-4-morpholin-4-ylphenyl)-2-oxo-...
Create Date: 2006-10-26
CID: 11575714

203. BAY 59-7939 Analog 17; SCHEMBL78508; BDBM7842 ...
MW:     480.332320 g/mol MF: C19H18BrN3O5S
IUPAC name: 5-bromo-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3...
Create Date: 2006-10-26
CID: 11569203

204. BAY 59-7939 Analog 10; SCHEMBL78027; BDBM7532 ...
MW:     438.903503 g/mol MF: C19H20ClFN4O3S
IUPAC name: 5-chloro-N-[[(5S)-3-(3-fluoro-4-piperazin-1-ylphenyl)-2-oxo-...
Create Date: 2006-10-25
CID: 10274887

205. BAY 59-7939 Analog 7; SCHEMBL79715; BDBM7495 ...
MW:     421.897800 g/mol MF: C19H20ClN3O4S
IUPAC name: 5-chloro-N-[[(5S)-3-(4-morpholin-4-ylphenyl)-2-oxo-1,3-oxazo...
Create Date: 2006-10-25
CID: 10273747

206. BAY 59-7939 Analog 11; SCHEMBL77424; BDBM7552 ...
MW:     419.881920 g/mol MF: C19H18ClN3O4S
IUPAC name: 5-chloro-N-[[(5S)-2-oxo-3-[4-(2-oxopyrrolidin-1-yl)phenyl]-1...
Create Date: 2006-10-25
CID: 10202260

207. Danifos; PTMD; PTMP ...
MW:     326.799702 g/mol MF: C11H16ClO3PS2
IUPAC name: 1-chloro-4-(diethoxyphosphorylsulfanylmethylsulfanyl)benzene
Create Date: 2005-03-27
CID: 23559

208. Azo analog I; AC1O5PX1; 9,11-Azoprosta-5,13-dienoic acid ...
MW:     332.480280 g/mol MF: C20H32N2O2
IUPAC name: (Z)-7-[(1S,4R,6R)-4-[(E)-oct-6-enyl]-2,3-diazabicyclo[2.2.1]...
Create Date: 2006-04-28
CID: 6438575

209. UNII-50MQH6767O; 50MQH6767O; NZQRTHJPVKPTBV-UHFFFAOYSA-N ...
MW:     375.890580 g/mol MF: C24H22ClNO
IUPAC name: [1-(5-chloropentyl)indol-3-yl]-naphthalen-1-ylmethanone
Create Date: 2015-04-28
CID: 91713116

210. benzothiazine-containing analog, 3a; pyridazin-3-one, 2; BDBM30448
MW:     536.644160 g/mol MF: C22H24N4O6S3
IUPAC name: N-[(3Z)-3-[2-(3-methylbutyl)-3,5-dioxo-6-thiophen-2-ylpyrida...
Create Date: 2009-04-22
CID: 25227372

211. Adenine analogue; [(1S,2S,4S,5S)-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)-4-bicyclo[3.1.0]hexanyl]methanol; AC1MHE0E ...
MW:     275.306380 g/mol MF: C13H17N5O2
IUPAC name: [(1S,2S,4S,5S)-4-(6-aminopurin-9-yl)-1-(hydroxymethyl)-2-bic...
Create Date: 2005-08-01
CID: 3001872

212. Bentyl analog; AC1LAOCT; diethyl-[2-[1-(3-methylbutyl)cyclohexanecarbonyl]oxyethyl]azanium chloride
MW:     333.936940 g/mol MF: C18H36ClNO2
IUPAC name: diethyl-[2-[1-(3-methylbutyl)cyclohexanecarbonyl]oxyethyl]az...
Create Date: 2005-03-27
CID: 517290

213. Guanine analogue; AC1LAPI6; 2-Amino-9-((1S,2S,4S,5S)-4,5-bis-hydroxymethyl-bicyclo[3.1.0]hex-2-yl)-9H-purin-6-ol ...
MW:     291.305780 g/mol MF: C13H17N5O3
IUPAC name: 2-amino-9-[(2S,4S,5S)-1,2-bis(hydroxymethyl)-4-bicyclo[3.1.0...
Create Date: 2005-08-01
CID: 472614

214. Uracil analogue; 1-[(1S,2S,4S)-4,5-bis(hydroxymethyl)-2-bicyclo[3.1.0]hexanyl]pyrimidine-2,4-dione; AC1LAPI0 ...
MW:     252.266440 g/mol MF: C12H16N2O4
IUPAC name: 1-[(2S,4S,5S)-1,2-bis(hydroxymethyl)-4-bicyclo[3.1.0]hexanyl...
Create Date: 2005-08-01
CID: 472611

215. IsoquinCON cyclohex urethane analog; AC1L9RJ6; CHEMBL321571 ...
MW:     529.711280 g/mol MF: C30H47N3O5
IUPAC name: [(3R)-oxan-3-yl] N-[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcar...
Create Date: 2005-08-01
CID: 454288

216. IsoquinCON cyclohex urethane analog; AC1L9RJ5; CHEMBL327277 ...
MW:     529.711280 g/mol MF: C30H47N3O5
IUPAC name: [(3S)-oxan-3-yl] N-[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcar...
Create Date: 2005-08-01
CID: 454287

217. Cytosine analog; 4-amino-1-[(2R,4R)-2-(hydroxymethyl)-3,6-dioxabicyclo[3.1.0]hexan-4-yl]pyrimidin-2-one; AC1L9PNC ...
MW:     225.201340 g/mol MF: C9H11N3O4
IUPAC name: 4-amino-1-[(2R,4R)-4-(hydroxymethyl)-3,6-dioxabicyclo[3.1.0]...
Create Date: 2005-08-01
CID: 451444

218. TNP-470 analog; W-1802; 1227266-32-1
MW:     339.426560 g/mol MF: C18H29NO5
IUPAC name: [(3R,4S,5S,6R)-5-methoxy-4-[2-methyl-3-(3-methylbut-2-enyl)o...
Create Date: 2014-07-01
CID: 74890495

219. (+)-Furanoindoline Analogue; (-)-Furanoindoline Analogue; CHEMBL306155
MW:     705.715900 g/mol MF: C37H35N7O8
Create Date: 2011-12-27
CID: 54730499

220. TNP-470 analog
MW:     339.426560 g/mol MF: C18H29NO5
IUPAC name: [5-methoxy-4-[2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-...
Create Date: 2011-10-30
CID: 53399373

221. 1'-epi-Benazeprilat Benzyl Ester Analogue, Trifluoroacetic Acid Salt; 1356930-99-8; CTK8F3309 ...
MW:     600.582250 g/mol MF: C31H31F3N2O7
IUPAC name: 2-[(3S)-2-oxo-3-[[(2R)-1-oxo-4-phenyl-1-phenylmethoxybutan-2...
Create Date: 2010-07-26
CID: 46780637

222. 914471-09-3; IDO5L; INCB024360 ...
MW:     271.635583 g/mol MF: C9H7ClFN5O2
IUPAC name: (4E)-4-[(3-chloro-4-fluoroanilino)-nitrosomethylidene]-1,2,5...
Create Date: 2007-01-03
CID: 11978742

223. CHEMBL277716; AG7088 analogue 2d; AC1O55QX ...
MW:     606.709180 g/mol MF: C33H42N4O7
IUPAC name: ethyl (E,4S)-4-[[(2S)-2-[[(2S)-3-methyl-2-(phenylmethoxycarb...
Create Date: 2006-04-29
CID: 6478229

224. CHEMBL20636; AG7088 analogue 2a; AC1O53DF ...
MW:     599.650423 g/mol MF: C30H38FN5O7
IUPAC name: ethyl (E,4S)-4-[[(2S)-3-(4-fluorophenyl)-2-[[(2S)-3-methyl-2...
Create Date: 2006-04-29
CID: 6476897

225. Cytosine analogue; 4-amino-1-[(1S,2S,4S)-4,5-bis(hydroxymethyl)-2-bicyclo[3.1.0]hexanyl]pyrimidin-2-one; AC1LAPI3 ...
MW:     251.281680 g/mol MF: C12H17N3O3
IUPAC name: 4-amino-1-[(2S,4S,5S)-1,2-bis(hydroxymethyl)-4-bicyclo[3.1.0...
Create Date: 2005-08-01
CID: 472612

226. LY289612 analog, sulfinyl isostere; AC1L9SXW; N'-[3-[[2-[(1,1-Dimethylethyl)amino]carbonyl]phenyl]sulfinyl]-2-hydroxy-1-(phenylmethyl)propyl]-2-[(-2-quinolinylcarbonyl)amino]butanediamide, [1S-[1R*(R*),2R*]]
MW:     657.779060 g/mol MF: C35H39N5O6S
IUPAC name: N-[(3S)-4-[2-(tert-butylcarbamoyl)phenyl]sulfinyl-3-hydroxy-...
Create Date: 2005-08-01
CID: 455493

227. LY289612 analog, sulfinyl isostere; AC1L9SXT; CHEMBL351265 ...
MW:     657.779060 g/mol MF: C35H39N5O6S
IUPAC name: (2S)-N-[(2S,3S)-4-[2-(tert-butylcarbamoyl)phenyl]sulfinyl-3-...
Create Date: 2005-08-01
CID: 455492

228. LY289612 analog, sulfide isostere; AC1L9SXQ; CHEMBL350857 ...
MW:     641.779660 g/mol MF: C35H39N5O5S
IUPAC name: (2S)-N-[(2S,3R)-4-[2-(tert-butylcarbamoyl)phenyl]sulfanyl-3-...
Create Date: 2005-08-01
CID: 455491

229. CHEMBL355533; LY289612 analog, sulfide isostere; AC1L9SXK ...
MW:     641.779660 g/mol MF: C35H39N5O5S
IUPAC name: (2S)-N-[(2S,3S)-4-[2-(tert-butylcarbamoyl)phenyl]sulfanyl-3-...
Create Date: 2005-08-01
CID: 455489

230. 6-Amino-7-chloro-5,8-dioxoquinoline; 18892-39-2; 6-Amino-7-chloro-5,8-quinolinedione ...
MW:     208.601200 g/mol MF: C9H5ClN2O2
IUPAC name: 6-amino-7-chloroquinoline-5,8-dione
Create Date: 2005-03-26
CID: 96583

231. Azinphosmethyl oxon; AZINPHOS-METHYL OXON; 961-22-8 ...
MW:     301.258742 g/mol MF: C10H12N3O4PS
IUPAC name: 3-(dimethoxyphosphorylsulfanylmethyl)-1,2,3-benzotriazin-4-o...
Create Date: 2005-03-27
CID: 13746

232. Fluasterone; UNII-R7M5UGD04G; 16alpha-Fluoro-5-androsten-17-one ...
MW:     290.415483 g/mol MF: C19H27FO
IUPAC name: (8R,9S,10R,13S,14S,16R)-16-fluoro-10,13-dimethyl-1,2,3,4,7,8...
Create Date: 2005-08-08
CID: 133967

233. Montelukast Gem-dimethylmethylene Analogue; 162489-70-5; HE316221
MW:     588.199120 g/mol MF: C35H38ClNO3S
IUPAC name: 4-[1-[3-[2-(7-chloroquinolin-2-yl)ethenyl]phenyl]-3-[2-(2-hy...
Create Date: 2012-06-13
CID: 57002635

234. 3-Cl-AHPC analogue 10; 3-Cl-AHPC analogue, 10; CHEMBL461415 ...
MW:     436.970360 g/mol MF: C27H29ClO3
IUPAC name: (E)-3-[3-chloro-4-[3-(3,5-dimethyl-1-adamantyl)-4-hydroxyphe...
Create Date: 2007-12-07
CID: 23577110

235. N-(5-phenyl-1H-indazol-3-yl)butanamide; indazole analog 4; AC1O6ZTA ...
MW:     279.336380 g/mol MF: C17H17N3O
IUPAC name: N-(5-phenyl-1H-indazol-3-yl)butanamide
Create Date: 2006-05-10
CID: 6539551

236. CHEMBL52529; Balanol analog 5; AC1NS3DB ...
MW:     521.472220 g/mol MF: C27H23NO10
IUPAC name: 2-[2,6-dihydroxy-4-[(1R,2R)-2-[(4-hydroxybenzoyl)amino]cyclo...
Create Date: 2006-01-30
CID: 5327922

237. CHEMBL59828; Balanol analog 4; AC1NS3D8 ...
MW:     522.460280 g/mol MF: C26H22N2O10
IUPAC name: 2-[2,6-dihydroxy-4-[(3R,4R)-4-[(4-hydroxybenzoyl)amino]pyrro...
Create Date: 2006-01-30
CID: 5327921

238. CHEMBL67442; Balanol analog 3; AC1NS3D5 ...
MW:     536.486860 g/mol MF: C27H24N2O10
IUPAC name: 2-[2,6-dihydroxy-4-[(3R,4R)-3-[(4-hydroxybenzoyl)amino]piper...
Create Date: 2006-01-30
CID: 5327920

239. 5-Acetamido-3,5-dideoxygalactosyloctulosonic acid; 30100-61-9; Sialic acid C8 analog ...
MW:     279.243880 g/mol MF: C10H17NO8
IUPAC name: (4S,5R,6R,7R)-5-acetamido-4,6,7,8-tetrahydroxy-2-oxooctanoic...
Create Date: 2005-08-09
CID: 3081461

240. 5-Acetamido-3,5-dideoxygalactosylheptulosonic acid; 17048-96-3; Sialic acid C7 analog ...
MW:     249.217900 g/mol MF: C9H15NO7
IUPAC name: (4S,5R,6R)-5-acetamido-4,6,7-trihydroxy-2-oxoheptanoic acid
Create Date: 2005-08-09
CID: 3081443

241. BALANOL ANALOG 8; DB02155; (3S,4R)-3-{3-[(2R)-butan-2-yl]-4-hydroxybenzamido}azepan-4-yl 4-(2-hydroxy-5-methoxybenzoyl)benzoate
MW:     560.637440 g/mol MF: C32H36N2O7
IUPAC name: [(3S,4R)-3-[[3-[(2R)-butan-2-yl]-4-hydroxybenzoyl]amino]azep...
Create Date: 2010-11-09
CID: 46936313

242. BALANOL ANALOG 2; ZINC12501371; DB01940 ...
MW:     474.505140 g/mol MF: C27H26N2O6
IUPAC name: [(3S,4R)-3-[(4-hydroxybenzoyl)amino]azepan-4-yl] 4-(2-hydrox...
Create Date: 2010-11-09
CID: 46936265

243. benzothiazole analogue, 16j; CHEMBL459920; Benzothiazole-based analogue, 1 ...
MW:     513.652120 g/mol MF: C24H23N3O4S3
IUPAC name: N-[4-(4-methoxy-1,3-benzothiazol-2-yl)phenyl]-1-thiophen-2-y...
Create Date: 2009-03-16
CID: 25187967

244. Balanol analog 28; BDBM3162; CHEMBL306170 ...
MW:     589.589240 g/mol MF: C32H31NO10
IUPAC name: 2-[2,6-dihydroxy-4-[[2-[(4-hydroxybenzoyl)amino]-4,7,7-trime...
Create Date: 2006-12-27
CID: 11972484

245. CHEMBL99775; Montelukast Gem-dimethylmethylene Analogue; 162489-70-5 ...
MW:     588.199120 g/mol MF: C35H38ClNO3S
IUPAC name: 4-[(1R)-1-[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]phenyl]-3...
Create Date: 2006-10-25
CID: 10099896

246. Retinoyl-AZT; 3'-Azido-3'-deoxythymidine-retinoic acid ester; 125780-97-4 ...
MW:     549.661160 g/mol MF: C30H39N5O5
IUPAC name: [(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxol...
Create Date: 2006-04-29
CID: 6450960

247. Ro-23-7553; 1,25(OH)2-16-Ene-23-yne-D3; Ro 23-7553 ...
MW:     410.588820 g/mol MF: C27H38O3
IUPAC name: (1R,3S,5Z)-5-[(2E)-2-[(3aS,7aS)-1-[(2R)-6-hydroxy-6-methylhe...
Create Date: 2006-04-28
CID: 6438384

248. CHEMBL121492; Paullone Analog 8; AC1NSACP ...
MW:     369.339870 g/mol MF: C20H14F3N3O
IUPAC name: 3-[6-oxo-9-(trifluoromethyl)-7,12-dihydro-5H-indolo[3,2-d][1...
Create Date: 2006-01-30
CID: 5331105

249. Balanol Analog 42; AC1NS3F2; BDBM3184 ...
MW:     704.699780 g/mol MF: C35H32N2O12S
IUPAC name: 2-[2,6-dihydroxy-4-[(3R,4R)-3-[(4-hydroxybenzoyl)amino]-1-(4...
Create Date: 2006-01-30
CID: 5327945

250. U-85961; 136816-72-3; Piperazine, 1-(3-(ethylamino)-2-pyridinyl)-4-(1H-indol-2-ylcarbonyl)- ...
MW:     349.429520 g/mol MF: C20H23N5O
IUPAC name: [4-[3-(ethylamino)pyridin-2-yl]piperazin-1-yl]-(1H-indol-2-y...
Create Date: 2005-08-01
CID: 453217

251. VANCOMYCIN; Vancocin; Vancoled ...
MW:    1449.253600 g/mol MF: C66H75Cl2N9O24
Create Date: 2005-06-24
CID: 14969

252. YM4 Doxorubicin analog; AC1MIXQ6; YM 4 ...
MW:     636.645740 g/mol MF: C33H36N2O11
IUPAC name: 9-(1,2-dihydroxyethyl)-6,9,11-trihydroxy-7-[5-hydroxy-6-meth...
Create Date: 2005-08-09
CID: 3081881

253. YM6 Doxorubicin analog; AC1L52KH; YM 6 ...
MW:     725.740460 g/mol MF: C39H39N3O11
IUPAC name: 7-[4-[bis(pyridin-3-ylmethyl)amino]-5-hydroxy-6-methyloxan-2...
Create Date: 2005-08-09
CID: 196927

254. Florfenicol Chloro Analogue; ZINC72399839; 2,2-Dchloro-N-[(1R,2S)-1-(chloromethyl)-2-hydroxy-2-[4-(methylsulfonyl)phenyl]ethyl]acetamide
MW:     374.667860 g/mol MF: C12H14Cl3NO4S
IUPAC name: 2,2-dichloro-N-[(1R,2S)-3-chloro-1-hydroxy-1-(4-methylsulfon...
Create Date: 2013-05-17
CID: 71316773

255. INCB024360; 914471-09-3; INCB024360 analogue ...
MW:     271.635583 g/mol MF: C9H7ClFN5O2
IUPAC name: 4-[(3-chloro-4-fluoroanilino)-nitrosomethylidene]-1,2,5-oxad...
Create Date: 2011-10-30
CID: 53434622

256. Florfenicol Chloro Analogue; CTK8F9772
MW:     374.667860 g/mol MF: C12H14Cl3NO4S
IUPAC name: 2,2-dichloro-N-[(1R)-3-chloro-1-hydroxy-1-(4-methylsulfonylp...
Create Date: 2010-07-26
CID: 46781589

257. CHEMBL170388; Azaspirodioxolane analogue; BDBM50280540
MW:     169.220900 g/mol MF: C9H15NO2
IUPAC name: (4R)-2-methylspiro[1,3-dioxolane-4,3'-1-azabicyclo[2.2.1]hep...
Create Date: 2009-11-19
CID: 44379868

258. CHEMBL170489; Azaspirodioxolane analogue; BDBM50280550
MW:     169.220900 g/mol MF: C9H15NO2
IUPAC name: (2R)-2-methylspiro[1,3-dioxolane-4,3'-1-azabicyclo[2.2.1]hep...
Create Date: 2009-11-19
CID: 44379808

259. CHEMBL134830; Azaspirodioxolane analogue; BDBM50067479 ...
MW:     169.220900 g/mol MF: C9H15NO2
IUPAC name: (2S)-2-methylspiro[1,3-dioxolane-4,3'-1-azabicyclo[2.2.1]hep...
Create Date: 2009-11-19
CID: 44354733

260. SCH 66336 analog; CHEMBL144202; BDBM14468 ...
MW:     639.809700 g/mol MF: C26H30Br2ClN5O2
IUPAC name: 4-[2-[4-[(11S)-3,10-dibromo-8-chloro-6,11-dihydro-5H-benzo[1...
Create Date: 2006-10-25
CID: 10416697

261. SCH 66336 analog; CHEMBL358796; SCHEMBL3314457 ...
MW:     639.809700 g/mol MF: C26H30Br2ClN5O2
IUPAC name: 4-[2-[4-[(11R)-3,10-dibromo-8-chloro-6,11-dihydro-5H-benzo[1...
Create Date: 2006-10-25
CID: 10054901

262. CHEMBL260243; N-[6-(furan-3-yl)-1H-indazol-3-yl]cyclopropanecarboxamide; indazole analogue 28 ...
MW:     267.282620 g/mol MF: C15H13N3O2
IUPAC name: N-[6-(furan-3-yl)-1H-indazol-3-yl]cyclopropanecarboxamide
Create Date: 2006-05-10
CID: 6539610

263. CHEMBL421207; N-[6-(furan-2-yl)-1H-indazol-3-yl]cyclopropanecarboxamide; indazole analogue 27 ...
MW:     267.282620 g/mol MF: C15H13N3O2
IUPAC name: N-[6-(furan-2-yl)-1H-indazol-3-yl]cyclopropanecarboxamide
Create Date: 2006-05-10
CID: 6539609

264. CHEMBL260929; N-[6-(1H-pyrrol-2-yl)-1H-indazol-3-yl]cyclopropanecarboxamide; indazole analogue 26 ...
MW:     266.297860 g/mol MF: C15H14N4O
IUPAC name: N-[6-(1H-pyrrol-2-yl)-1H-indazol-3-yl]cyclopropanecarboxamid...
Create Date: 2006-05-10
CID: 6539608

265. SB-735467; N-[6-(4-fluorophenyl)-1H-indazol-3-yl]cyclopropanecarboxamide; indazole analogue 25 ...
MW:     295.310963 g/mol MF: C17H14FN3O
IUPAC name: N-[6-(4-fluorophenyl)-1H-indazol-3-yl]cyclopropanecarboxamid...
Create Date: 2006-05-10
CID: 6539607

266. CHEMBL261660; N-[6-(3-fluorophenyl)-1H-indazol-3-yl]cyclopropanecarboxamide; indazole analogue 24 ...
MW:     295.310963 g/mol MF: C17H14FN3O
IUPAC name: N-[6-(3-fluorophenyl)-1H-indazol-3-yl]cyclopropanecarboxamid...
Create Date: 2006-05-10
CID: 6539606

267. N-[6-(2,3-difluorophenyl)-1H-indazol-3-yl]cyclopropanecarboxamide; indazole analogue 23; AC1O6ZWA ...
MW:     313.301426 g/mol MF: C17H13F2N3O
IUPAC name: N-[6-(2,3-difluorophenyl)-1H-indazol-3-yl]cyclopropanecarbox...
Create Date: 2006-05-10
CID: 6539605

268. N-[6-(3,4-difluorophenyl)-1H-indazol-3-yl]cyclopropanecarboxamide; indazole analogue 22; AC1O6ZW8 ...
MW:     313.301426 g/mol MF: C17H13F2N3O
IUPAC name: N-[6-(3,4-difluorophenyl)-1H-indazol-3-yl]cyclopropanecarbox...
Create Date: 2006-05-10
CID: 6539604

269. SB-735465; N-[6-(2,5-difluorophenyl)-1H-indazol-3-yl]cyclopropanecarboxamide; indazole analogue 21 ...
MW:     313.301426 g/mol MF: C17H13F2N3O
IUPAC name: N-[6-(2,5-difluorophenyl)-1H-indazol-3-yl]cyclopropanecarbox...
Create Date: 2006-05-10
CID: 6539603

270. N-[6-(2-fluorophenyl)-1H-indazol-3-yl]cyclopropanecarboxamide; indazole analogue 20; AC1O6ZW4 ...
MW:     295.310963 g/mol MF: C17H14FN3O
IUPAC name: N-[6-(2-fluorophenyl)-1H-indazol-3-yl]cyclopropanecarboxamid...
Create Date: 2006-05-10
CID: 6539602

271. indazole analogue 19; AC1O6ZW2; BDBM8377 ...
MW:     294.307960 g/mol MF: C16H14N4O2
IUPAC name: N-[6-(6-oxo-1H-pyridin-3-yl)-1H-indazol-3-yl]cyclopropanecar...
Create Date: 2006-05-10
CID: 6539601

272. SB-742865; indazole analogue 18; AC1O6ZW0 ...
MW:     370.425520 g/mol MF: C18H18N4O3S
IUPAC name: N-[6-[4-(methanesulfonamido)phenyl]-1H-indazol-3-yl]cyclopro...
Create Date: 2006-05-10
CID: 6539600

273. SB-742864; indazole analogue 17; AC1O6ZVY ...
MW:     370.425520 g/mol MF: C18H18N4O3S
IUPAC name: N-[6-[3-(methanesulfonamido)phenyl]-1H-indazol-3-yl]cyclopro...
Create Date: 2006-05-10
CID: 6539599

274. CHEMBL407113; SB-741905; N-[6-(3-sulfamoylphenyl)-1H-indazol-3-yl]cyclopropanecarboxamide ...
MW:     356.398940 g/mol MF: C17H16N4O3S
IUPAC name: N-[6-(3-sulfamoylphenyl)-1H-indazol-3-yl]cyclopropanecarboxa...
Create Date: 2006-05-10
CID: 6539598

275. SB-738482; N-[6-(4-sulfamoylphenyl)-1H-indazol-3-yl]cyclopropanecarboxamide; indazole analogue 15 ...
MW:     356.398940 g/mol MF: C17H16N4O3S
IUPAC name: N-[6-(4-sulfamoylphenyl)-1H-indazol-3-yl]cyclopropanecarboxa...
Create Date: 2006-05-10
CID: 6539597

276. indazole analogue 14; AC1O6ZVS; BDBM8372 ...
MW:     328.367240 g/mol MF: C20H16N4O
IUPAC name: N-(6-quinolin-6-yl-1H-indazol-3-yl)cyclopropanecarboxamide
Create Date: 2006-05-10
CID: 6539596

277. CHEMBL261659; N-[6-(1H-indol-5-yl)-1H-indazol-3-yl]cyclopropanecarboxamide; indazole analogue 13 ...
MW:     316.356540 g/mol MF: C19H16N4O
IUPAC name: N-[6-(1H-indol-5-yl)-1H-indazol-3-yl]cyclopropanecarboxamide
Create Date: 2006-05-10
CID: 6539595

278. indazole analogue 12; AC1O6ZVO; BDBM8370 ...
MW:     293.319900 g/mol MF: C17H15N3O2
IUPAC name: N-[6-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,2-dihydroindazol-...
Create Date: 2006-05-10
CID: 6539594

279. CHEMBL405021; SB-732941; N-(6-phenyl-1H-indazol-3-yl)cyclopropanecarboxamide ...
MW:     277.320500 g/mol MF: C17H15N3O
IUPAC name: N-(6-phenyl-1H-indazol-3-yl)cyclopropanecarboxamide
Create Date: 2006-05-10
CID: 6539593

280. CHEMBL260928; indazole analogue 30; AC1O6ZVA ...
MW:     283.348220 g/mol MF: C15H13N3OS
IUPAC name: N-(6-thiophen-3-yl-1H-indazol-3-yl)cyclopropanecarboxamide
Create Date: 2006-05-10
CID: 6539587

281. CHEMBL318522; indazole analogue 29; AC1O6ZV8 ...
MW:     283.348220 g/mol MF: C15H13N3OS
IUPAC name: N-(6-thiophen-2-yl-1H-indazol-3-yl)cyclopropanecarboxamide
Create Date: 2006-05-10
CID: 6539586

282. CHEMBL408019; N-[6-(3-hydroxyphenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]cyclopropanecarboxamide; AC1O6ZUA ...
MW:     294.307960 g/mol MF: C16H14N4O2
IUPAC name: N-[6-(3-hydroxyphenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]cyclop...
Create Date: 2006-05-10
CID: 6539569

283. 6-aryl-pyrazolo[3,4-b]pyridine analogue 5; AC1O6ZU4; BDBM8341 ...
MW:     294.307960 g/mol MF: C16H14N4O2
IUPAC name: N-[6-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,2-dihydropyrazolo...
Create Date: 2006-05-10
CID: 6539566

284. Paullone Analog 56; BDBM7317; CHEMBL120547 ...
MW:     233.307700 g/mol MF: C17H15N
Create Date: 2006-01-30
CID: 5331133

285. Paullone Analog 55; AC1NSAEV; BDBM7316 ...
MW:     462.992560 g/mol MF: C29H19ClN2S
IUPAC name: 4-(4-chlorophenyl)-2-naphthalen-2-yl-5,7-dihydropyrido[3,2-d...
Create Date: 2006-01-30
CID: 5331132

286. CHEMBL317562; Paullone Analog 54; AC1NSAES ...
MW:     527.406980 g/mol MF: C26H27BrN2O5
IUPAC name: ditert-butyl 9-bromo-6-oxo-7H-indolo[3,2-d][1]benzazepine-5,...
Create Date: 2006-01-30
CID: 5331131

287. CHEMBL420455; Paullone Analog 53; AC1NSAEP ...
MW:     627.522800 g/mol MF: C31H35BrN2O7
IUPAC name: tritert-butyl 9-bromo-6-oxo-7H-indolo[3,2-d][1]benzazepine-5...
Create Date: 2006-01-30
CID: 5331130

288. Paullone Analog 52; AC1NSAEM; BDBM7313 ...
MW:     384.516540 g/mol MF: C23H16N2S2
IUPAC name: 2-phenyl-4-thiophen-2-yl-5,7-dihydropyrido[3,2-d][1]benzazep...
Create Date: 2006-01-30
CID: 5331129

289. Paullone Analog 51; BDBM7312; CHEMBL331759 ...
MW:     312.203760 g/mol MF: C17H14BrN
Create Date: 2006-01-30
CID: 5331128

290. CHEMBL100485; Paullone Analog 49; AC1NSAEJ ...
MW:     527.406980 g/mol MF: C26H27BrN2O5
IUPAC name: ditert-butyl 9-bromo-6-oxo-7,12-dihydroindolo[3,2-d][1]benza...
Create Date: 2006-01-30
CID: 5331127

291. CHEMBL97844; Paullone Analog 48; AC1NSAEG ...
MW:     355.228500 g/mol MF: C18H15BrN2O
IUPAC name: 9-bromo-5-ethyl-7,12-dihydroindolo[3,2-d][1]benzazepin-6-one
Create Date: 2006-01-30
CID: 5331126

292. CHEMBL99779; Paullone Analog 46; AC1NSAED ...
MW:     417.297880 g/mol MF: C23H17BrN2O
IUPAC name: 5-benzyl-9-bromo-7,12-dihydroindolo[3,2-d][1]benzazepin-6-on...
Create Date: 2006-01-30
CID: 5331125

293. CHEMBL99280; Paullone Analog 43; AC1NSAEA ...
MW:     367.239200 g/mol MF: C19H15BrN2O
IUPAC name: 9-bromo-12-prop-2-enyl-5,7-dihydroindolo[3,2-d][1]benzazepin...
Create Date: 2006-01-30
CID: 5331124

294. CHEMBL100312; Paullone Analog 42; AC1NSAE7 ...
MW:     427.291160 g/mol MF: C21H19BrN2O3
IUPAC name: tert-butyl 9-bromo-6-oxo-5,7-dihydroindolo[3,2-d][1]benzazep...
Create Date: 2006-01-30
CID: 5331123

295. CHEMBL121957; Paullone Analog 41; AC1NSAE4 ...
MW:     442.173780 g/mol MF: C17H10F3IN2O
IUPAC name: 2-iodo-9-(trifluoromethyl)-7,12-dihydro-5H-indolo[3,2-d][1]b...
Create Date: 2006-01-30
CID: 5331122

296. CHEMBL316485; Paullone Analog 39; AC1NSAE1 ...
MW:     341.201920 g/mol MF: C17H13BrN2O
IUPAC name: 9-bromo-5-methyl-7,12-dihydroindolo[3,2-d][1]benzazepin-6-on...
Create Date: 2006-01-30
CID: 5331121

297. CHEMBL120664; Paullone Analog 38; AC1NSADY ...
MW:     438.441650 g/mol MF: C25H21F3N2O2
IUPAC name: 2-[2-(1-hydroxycyclohexyl)ethynyl]-9-(trifluoromethyl)-7,12-...
Create Date: 2006-01-30
CID: 5331120

298. CHEMBL52551; Paullone Analog 36; AC1NSADV ...
MW:     343.240940 g/mol MF: C16H11BrN2S
IUPAC name: 9-bromo-7,12-dihydro-5H-indolo[3,2-d][1]benzazepine-6-thione
Create Date: 2006-01-30
CID: 5331119

299. CHEMBL328627; Paullone Analog 35; AC1NSADS ...
MW:     355.228500 g/mol MF: C18H15BrN2O
IUPAC name: 9-bromo-12-ethyl-5,7-dihydroindolo[3,2-d][1]benzazepin-6-one
Create Date: 2006-01-30
CID: 5331118

300. CHEMBL119989; Paullone Analog 34; AC1NSADP ...
MW:     384.351210 g/mol MF: C21H15F3N2O2
IUPAC name: 2-[(E)-3-oxobut-1-enyl]-9-(trifluoromethyl)-7,12-dihydro-5H-...
Create Date: 2006-01-30
CID: 5331117

301. CHEMBL328164; Paullone Analog 33; AC1NSADM ...
MW:     357.267520 g/mol MF: C17H13BrN2S
IUPAC name: 9-bromo-6-methylsulfanyl-7,12-dihydroindolo[3,2-d][1]benzaze...
Create Date: 2006-01-30
CID: 5331116

302. CHEMBL121958; Paullone Analog 32; AC1NSADJ ...
MW:     400.350610 g/mol MF: C21H15F3N2O3
IUPAC name: methyl (E)-3-[6-oxo-9-(trifluoromethyl)-7,12-dihydro-5H-indo...
Create Date: 2006-01-30
CID: 5331115

303. CHEMBL98275; Paullone Analog 28; AC1NSADG ...
MW:     342.189980 g/mol MF: C16H12BrN3O
IUPAC name: N-(9-bromo-7,12-dihydroindolo[3,2-d][1]benzazepin-6-yl)hydro...
Create Date: 2006-01-30
CID: 5331114

304. CHEMBL317539; Paullone Analog 24; AC1NSADD ...
MW:     399.238000 g/mol MF: C19H15BrN2O3
IUPAC name: methyl 2-(9-bromo-6-oxo-7,12-dihydroindolo[3,2-d][1]benzazep...
Create Date: 2006-01-30
CID: 5331113

305. CHEMBL419054; Paullone Analog 23; AC1NSADA ...
MW:     367.323990 g/mol MF: C20H12F3N3O
IUPAC name: (E)-3-[6-oxo-9-(trifluoromethyl)-7,12-dihydro-5H-indolo[3,2-...
Create Date: 2006-01-30
CID: 5331112

306. CHEMBL318208; Paullone Analog 22; AC1NSAD7 ...
MW:     341.201920 g/mol MF: C17H13BrN2O
IUPAC name: 9-bromo-12-methyl-5,7-dihydroindolo[3,2-d][1]benzazepin-6-on...
Create Date: 2006-01-30
CID: 5331111

307. CHEMBL99803; Paullone Analog 21; AC1NSAD4 ...
MW:     371.227900 g/mol MF: C18H15BrN2O2
IUPAC name: 9-bromo-12-(2-hydroxyethyl)-5,7-dihydroindolo[3,2-d][1]benza...
Create Date: 2006-01-30
CID: 5331110

308. Paullone Analog 20; 2-iodopaullone; AC1NSAD1 ...
MW:     374.175810 g/mol MF: C16H11IN2O
IUPAC name: 2-iodo-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-one
Create Date: 2006-01-30
CID: 5331109

309. Paullone Analog 19; AC1NSACY; 2-Bromo-9-Nitropaullone ...
MW:     372.172900 g/mol MF: C16H10BrN3O3
IUPAC name: 2-bromo-9-nitro-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6...
Create Date: 2006-01-30
CID: 5331108

310. CHEMBL346406; Paullone Analog 18; AC1NSACV ...
MW:     370.324630 g/mol MF: C20H13F3N2O2
IUPAC name: 2-(3-hydroxyprop-1-ynyl)-9-(trifluoromethyl)-7,12-dihydro-5H...
Create Date: 2006-01-30
CID: 5331107

311. CHEMBL100220; Paullone Analog 10; AC1NSACS ...
MW:     399.238000 g/mol MF: C19H15BrN2O3
IUPAC name: methyl 2-(9-bromo-6-oxo-5,7-dihydroindolo[3,2-d][1]benzazepi...
Create Date: 2006-01-30
CID: 5331106

312. Balanol Analog 35c; AC1NS3GQ; BDBM3206 ...
MW:     507.488700 g/mol MF: C27H25NO9
IUPAC name: [(3S,4R)-4-[(4-hydroxyphenyl)methyl]pyrrolidin-3-yl] 3,5-dih...
Create Date: 2006-01-30
CID: 5327965

313. Balanol Analog 29c; AC1NS3GN; BDBM3205 ...
MW:     506.500640 g/mol MF: C28H26O9
IUPAC name: [(1R,2S)-2-[(4-hydroxyphenyl)methyl]cyclopentyl] 3,5-dihydro...
Create Date: 2006-01-30
CID: 5327964

314. BALANOL ANALOG 2; AC1NRA7T; [3-[(4-hydroxybenzoyl)amino]azepan-4-yl] 4-(2-hydroxybenzoyl)benzoate ...
MW:     474.505140 g/mol MF: C27H26N2O6
IUPAC name: [3-[(4-hydroxybenzoyl)amino]azepan-4-yl] 4-(2-hydroxybenzoyl...
Create Date: 2005-11-29
CID: 5287747

315. AC1NQUK3; N-alkoxysulfonamide analog 9; BDBM9169 ...
MW:     605.742720 g/mol MF: C30H43N3O8S
IUPAC name: methyl N-[(2S)-1-[[(2S,3R)-4-[cyclopentyloxy-(4-methoxypheny...
Create Date: 2005-10-07
CID: 5279201

316. AC1NQUK0; N-alkoxysulfonamide analog 8; BDBM9168 ...
MW:     548.648340 g/mol MF: C27H36N2O8S
IUPAC name: [(3S)-oxolan-3-yl] N-[(2S,3R)-4-[cyclopentyloxy-(4-methoxyph...
Create Date: 2005-10-07
CID: 5279200

317. AC1NQUJX; N-alkoxysulfonamide analog 7; BDBM9167 ...
MW:     542.643760 g/mol MF: C28H34N2O7S
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl...
Create Date: 2005-10-07
CID: 5279199

318. AC1NQUJU; N-alkoxysulfonamide analog 6; BDBM9166 ...
MW:     562.717980 g/mol MF: C29H42N2O7S
IUPAC name: tert-butyl N-[(2S,3R)-4-[cyclohexylmethoxy-(4-methoxyphenyl)...
Create Date: 2005-10-07
CID: 5279198

319. AC1NQUJR; N-alkoxysulfonamide analog 5; BDBM9165 ...
MW:     534.664820 g/mol MF: C27H38N2O7S
IUPAC name: tert-butyl N-[(2S,3R)-4-[cyclopentyloxy-(4-methoxyphenyl)sul...
Create Date: 2005-10-07
CID: 5279197

320. AC1NQUJO; N-alkoxysulfonamide analog 4; BDBM9164 ...
MW:     548.691400 g/mol MF: C28H40N2O7S
IUPAC name: tert-butyl N-[(2S,3R)-4-[cyclohexyloxy-(4-methoxyphenyl)sulf...
Create Date: 2005-10-07
CID: 5279196

321. AC1NQUJL; N-alkoxysulfonamide analog 3; BDBM9163 ...
MW:     522.654120 g/mol MF: C26H38N2O7S
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl...
Create Date: 2005-10-07
CID: 5279195

322. AC1NQUJI; N-alkoxysulfonamide analog 2; BDBM9162 ...
MW:     536.680700 g/mol MF: C27H40N2O7S
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl...
Create Date: 2005-10-07
CID: 5279194

323. AC1NQUJF; ENTRY A; N-alkoxysulfonamide analog 1 ...
MW:     508.627540 g/mol MF: C25H36N2O7S
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl...
Create Date: 2005-10-07
CID: 5279193

324. 149488-31-3; Thiourea, N-(2-(3-ethoxyphenyl)ethyl)-N'-2-thiazolyl-; PETT Analog 13 ...
MW:     307.434280 g/mol MF: C14H17N3OS2
IUPAC name: 1-[2-(3-ethoxyphenyl)ethyl]-3-(1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001172

325. PT-308; 149485-75-6; Thiourea, N-(2-(2-chlorophenyl)ethyl)-N'-2-thiazolyl- ...
MW:     297.826780 g/mol MF: C12H12ClN3S2
IUPAC name: 1-[2-(2-chlorophenyl)ethyl]-3-(1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001171

326. 172505-78-1; Thiourea, N-(2-(2-nitrophenyl)ethyl)-N'-2-thiazolyl-; PETT Analog 10 ...
MW:     308.379280 g/mol MF: C12H12N4O2S2
IUPAC name: 1-[2-(2-nitrophenyl)ethyl]-3-(1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001169

327. 149486-03-3; Thiourea, N-(2-(2-azidophenyl)ethyl)-N'-2-thiazolyl-; PETT Analog 9 ...
MW:     304.393880 g/mol MF: C12H12N6S2
IUPAC name: 1-[2-(2-azidophenyl)ethyl]-3-(1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001168

328. 149486-23-7; Thiourea, N-(2-(2-methylphenyl)ethyl)-N'-2-thiazolyl-; PETT Analog 8 ...
MW:     277.408300 g/mol MF: C13H15N3S2
IUPAC name: 1-[2-(2-methylphenyl)ethyl]-3-(1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001167

329. PT-320; PETT Analog 7; AC1MHDMD ...
MW:     293.407700 g/mol MF: C13H15N3OS2
IUPAC name: 1-[2-(4-methoxyphenyl)ethyl]-3-(1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001166

330. PT-319; 149485-99-4; Thiourea, N-(2-(3-methoxyphenyl)ethyl)-N'-2-thiazolyl- ...
MW:     293.407700 g/mol MF: C13H15N3OS2
IUPAC name: 1-[2-(3-methoxyphenyl)ethyl]-3-(1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001165

331. PT-302; 149485-77-8; Thiourea, N-(2-(4-fluorophenyl)ethyl)-N'-2-thiazolyl- ...
MW:     281.372183 g/mol MF: C12H12FN3S2
IUPAC name: 1-[2-(4-fluorophenyl)ethyl]-3-(1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001164

332. PT-304; 149486-04-4; Thiourea, N-(2-(3-fluorophenyl)ethyl)-N'-2-thiazolyl- ...
MW:     281.372183 g/mol MF: C12H12FN3S2
IUPAC name: 1-[2-(3-fluorophenyl)ethyl]-3-(1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001163

333. 149488-39-1; 1-[2-(2-ethoxy-6-fluorophenyl)ethyl]-3-(5-methylpyridin-2-yl)thiourea; Thiourea, N-(2-(2-ethoxy-6-fluorophenyl)ethyl)-N'-(5-methyl-2-pyridinyl)- ...
MW:     333.423603 g/mol MF: C17H20FN3OS
IUPAC name: 1-[2-(2-ethoxy-6-fluorophenyl)ethyl]-3-(5-methylpyridin-2-yl...
Create Date: 2005-08-01
CID: 3001123

334. PT-108; 149487-94-5; 1-[2-(2,6-difluorophenyl)ethyl]-3-(5-methylpyridin-2-yl)thiourea ...
MW:     307.361506 g/mol MF: C15H15F2N3S
IUPAC name: 1-[2-(2,6-difluorophenyl)ethyl]-3-(5-methylpyridin-2-yl)thio...
Create Date: 2005-08-01
CID: 3001122

335. 149488-58-4; Thiourea, N-(4-cyano-2-thiazolyl)-N'-(2-(2,6-difluorophenyl)ethyl)-; PETT Analog 56 ...
MW:     324.372106 g/mol MF: C13H10F2N4S2
IUPAC name: 1-(4-cyano-1,3-thiazol-2-yl)-3-[2-(2,6-difluorophenyl)ethyl]...
Create Date: 2005-08-01
CID: 3001121

336. 149487-86-5; 1-[2-(2,6-difluorophenyl)ethyl]-3-(4-ethyl-1,3-thiazol-2-yl)thiourea; Thiourea, N-(2-(2,6-difluorophenyl)ethyl)-N'-(4-ethyl-2-thiazolyl)- ...
MW:     327.415806 g/mol MF: C14H15F2N3S2
IUPAC name: 1-[2-(2,6-difluorophenyl)ethyl]-3-(4-ethyl-1,3-thiazol-2-yl)...
Create Date: 2005-08-01
CID: 3001120

337. Thiourea, N-2-benzothiazolyl-N'-(2-phenylethyl)-; 149485-21-2; PETT Analog 54 ...
MW:     313.440400 g/mol MF: C16H15N3S2
IUPAC name: 1-(1,3-benzothiazol-2-yl)-3-(2-phenylethyl)thiourea
Create Date: 2005-08-01
CID: 3001119

338. Thiourea, N-(3-bromo-2-pyridinyl)-N'-(2-phenylethyl)-; 149487-05-8; PETT Analog 51 ...
MW:     336.250060 g/mol MF: C14H14BrN3S
IUPAC name: 1-(3-bromopyridin-2-yl)-3-(2-phenylethyl)thiourea
Create Date: 2005-08-01
CID: 3001118

339. Thiourea, N-(2-phenylethyl)-N'-pyrazinyl-; PT-106; 149485-34-7 ...
MW:     258.342060 g/mol MF: C13H14N4S
IUPAC name: 1-(2-phenylethyl)-3-pyrazin-2-ylthiourea
Create Date: 2005-08-01
CID: 3001117

340. Thiourea, N-(2-phenylethyl)-N'-1,3,4-thiadiazol-2-yl-; 149484-90-2; 1-phenethyl-3-(1,3,4-thiadiazol-2-yl)thiourea ...
MW:     264.369780 g/mol MF: C11H12N4S2
IUPAC name: 1-(2-phenylethyl)-3-(1,3,4-thiadiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001116

341. Thiourea, N-(2-phenylethyl)-N'-1H-pyrazol-3-yl-; 149485-35-8; PETT Analog 47 ...
MW:     246.331360 g/mol MF: C12H14N4S
IUPAC name: 1-(2-phenylethyl)-3-(1H-pyrazol-5-yl)thiourea
Create Date: 2005-08-01
CID: 3001115

342. Thiourea, N-(5-chloro-2-thiazolyl)-N'-(2-phenylethyl)-; PT-312; 149486-85-1 ...
MW:     297.826780 g/mol MF: C12H12ClN3S2
IUPAC name: 1-(5-chloro-1,3-thiazol-2-yl)-3-(2-phenylethyl)thiourea
Create Date: 2005-08-01
CID: 3001114

343. 172505-88-3; 4-Thiazolecarboxylic acid, 2-((((2-phenylethyl)amino)thioxomethyl)amino)-, ethyl ester; PETT Analog 45 ...
MW:     335.444380 g/mol MF: C15H17N3O2S2
IUPAC name: ethyl 2-(2-phenylethylcarbamothioylamino)-1,3-thiazole-4-car...
Create Date: 2005-08-01
CID: 3001113

344. 149486-83-9; 4-Thiazolecarboxylic acid, 2-((((2-phenylethyl)amino)thioxomethyl)amino)-; 4-Thiazolecarboxylicacid, 2-[[[(2-phenylethyl)amino]thioxomethyl]amino]- ...
MW:     307.391220 g/mol MF: C13H13N3O2S2
IUPAC name: 2-(2-phenylethylcarbamothioylamino)-1,3-thiazole-4-carboxyli...
Create Date: 2005-08-01
CID: 3001112

345. PT-314; 149485-07-4; Thiourea, N-(2-phenylethyl)-N'-(4-(trifluoromethyl)-2-thiazolyl)- ...
MW:     331.379690 g/mol MF: C13H12F3N3S2
IUPAC name: 1-(2-phenylethyl)-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]th...
Create Date: 2005-08-01
CID: 3001111

346. PT-317; 149486-80-6; Thiourea, N-(4-(1-methylethyl)-2-thiazolyl)-N'-(2-phenylethyl)- ...
MW:     305.461460 g/mol MF: C15H19N3S2
IUPAC name: 1-(2-phenylethyl)-3-(4-propan-2-yl-1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001108

347. PT-313; Thiourea, N-(4-methyl-2-thiazolyl)-N'-(2-phenylethyl)-; 149485-00-7 ...
MW:     277.408300 g/mol MF: C13H15N3S2
IUPAC name: 1-(4-methyl-1,3-thiazol-2-yl)-3-(2-phenylethyl)thiourea
Create Date: 2005-08-01
CID: 3001105

348. PT-322; Thiourea, N-methyl-N'-(2-phenylethyl)-N-2-thiazolyl-; 172505-87-2 ...
MW:     277.408300 g/mol MF: C13H15N3S2
IUPAC name: 1-methyl-3-(2-phenylethyl)-1-(1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001104

349. Thiourea, N-(2-phenylpropyl)-N'-2-thiazolyl-; 149486-09-9; PETT Analog 33 ...
MW:     277.408300 g/mol MF: C13H15N3S2
IUPAC name: 1-(2-phenylpropyl)-3-(1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001101

350. 172505-85-0; Thiourea, N-(2-(2-furanyl)ethyl)-N'-2-thiazolyl-; Thiourea, N-[2-(2-furanyl)ethyl]-N'-2-thiazolyl- ...
MW:     253.343840 g/mol MF: C10H11N3OS2
IUPAC name: 1-[2-(furan-2-yl)ethyl]-3-(1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001099

351. 149485-73-4; Thiourea, N-(2-(1-methyl-1H-pyrrol-2-yl)ethyl)-N'-2-thiazolyl-; PETT Analog 28 ...
MW:     266.385660 g/mol MF: C11H14N4S2
IUPAC name: 1-[2-(1-methylpyrrol-2-yl)ethyl]-3-(1,3-thiazol-2-yl)thioure...
Create Date: 2005-08-01
CID: 3001098

352. 172505-84-9; Thiourea, N-(2-(4-pyridinyl)ethyl)-N'-2-thiazolyl-; Thiourea, N-[2-(4-pyridinyl)ethyl]-N'-2-thiazolyl- ...
MW:     264.369780 g/mol MF: C11H12N4S2
IUPAC name: 1-(2-pyridin-4-ylethyl)-3-(1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001097

353. 172505-83-8; Thiourea, N-(2-(3-pyridinyl)ethyl)-N'-2-thiazolyl-; Thiourea, N-[2-(3-pyridinyl)ethyl]-N'-2-thiazolyl- ...
MW:     264.369780 g/mol MF: C11H12N4S2
IUPAC name: 1-(2-pyridin-3-ylethyl)-3-(1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001096

354. 149486-07-7; Thiourea, N-(2-(2-pyridinyl)ethyl)-N'-2-thiazolyl-; Thiourea, N-[2-(2-pyridinyl)ethyl]-N'-2-thiazolyl- ...
MW:     264.369780 g/mol MF: C11H12N4S2
IUPAC name: 1-(2-pyridin-2-ylethyl)-3-(1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001095

355. PT-309; 149485-98-3; Thiourea, N-(2-(2-chloro-6-fluorophenyl)ethyl)-N'-2-thiazolyl- ...
MW:     315.817243 g/mol MF: C12H11ClFN3S2
IUPAC name: 1-[2-(2-chloro-6-fluorophenyl)ethyl]-3-(1,3-thiazol-2-yl)thi...
Create Date: 2005-08-01
CID: 3001094

356. PT-307; 149486-26-0; Thiourea, N-(2-(2,6-difluorophenyl)ethyl)-N'-2-thiazolyl- ...
MW:     299.362646 g/mol MF: C12H11F2N3S2
IUPAC name: 1-[2-(2,6-difluorophenyl)ethyl]-3-(1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001093

357. 149488-32-4; Thiourea, N-(2-(2-ethoxy-6-fluorophenyl)ethyl)-N'-2-thiazolyl-; PETT Analog 22 ...
MW:     325.424743 g/mol MF: C14H16FN3OS2
IUPAC name: 1-[2-(2-ethoxy-6-fluorophenyl)ethyl]-3-(1,3-thiazol-2-yl)thi...
Create Date: 2005-08-01
CID: 3001092

358. 149488-18-6; Thiourea, N-(2-(2-fluoro-6-methoxyphenyl)ethyl)-N'-2-thiazolyl-; PETT Analog 21 ...
MW:     311.398163 g/mol MF: C13H14FN3OS2
IUPAC name: 1-[2-(2-fluoro-6-methoxyphenyl)ethyl]-3-(1,3-thiazol-2-yl)th...
Create Date: 2005-08-01
CID: 3001091

359. 149486-41-9; Thiourea, N-(2-(5-bromo-2-methoxyphenyl)ethyl)-N'-2-thiazolyl-; PETT Analog 20 ...
MW:     372.303760 g/mol MF: C13H14BrN3OS2
IUPAC name: 1-[2-(5-bromo-2-methoxyphenyl)ethyl]-3-(1,3-thiazol-2-yl)thi...
Create Date: 2005-08-01
CID: 3001090

360. 149486-08-8; Thiourea, N-(2-(2,5-dimethoxyphenyl)ethyl)-N'-2-thiazolyl-; PETT Analog 19 ...
MW:     323.433680 g/mol MF: C14H17N3O2S2
IUPAC name: 1-[2-(2,5-dimethoxyphenyl)ethyl]-3-(1,3-thiazol-2-yl)thioure...
Create Date: 2005-08-01
CID: 3001089

361. 149486-31-7; Thiourea, N-(2-(2,6-dimethoxyphenyl)ethyl)-N'-2-thiazolyl-; PETT Analog 18 ...
MW:     323.433680 g/mol MF: C14H17N3O2S2
IUPAC name: 1-[2-(2,6-dimethoxyphenyl)ethyl]-3-(1,3-thiazol-2-yl)thioure...
Create Date: 2005-08-01
CID: 3001088

362. 172505-82-7; Thiourea, N-(2-(3-phenoxyphenyl)ethyl)-N'-2-thiazolyl-; PETT Analog 17 ...
MW:     355.477080 g/mol MF: C18H17N3OS2
IUPAC name: 1-[2-(3-phenoxyphenyl)ethyl]-3-(1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001087

363. 172505-81-6; Thiourea, N-(2-(3-(hexyloxy)phenyl)ethyl)-N'-2-thiazolyl-; PETT Analog 16 ...
MW:     363.540600 g/mol MF: C18H25N3OS2
IUPAC name: 1-[2-(3-hexoxyphenyl)ethyl]-3-(1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001086

364. 149488-33-5; Thiourea, N-(2-(3-(1-methylethoxy)phenyl)ethyl)-N'-2-thiazolyl-; PETT Analog 15 ...
MW:     321.460860 g/mol MF: C15H19N3OS2
IUPAC name: 1-[2-(3-propan-2-yloxyphenyl)ethyl]-3-(1,3-thiazol-2-yl)thio...
Create Date: 2005-08-01
CID: 3001085

365. 172505-80-5; Thiourea, N-(2-(3-propoxyphenyl)ethyl)-N'-2-thiazolyl-; PETT Analog 14 ...
MW:     321.460860 g/mol MF: C15H19N3OS2
IUPAC name: 1-[2-(3-propoxyphenyl)ethyl]-3-(1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001084

366. HI-275; CHEMBL317356; PT-102 ...
MW:     336.250060 g/mol MF: C14H14BrN3S
IUPAC name: 1-(5-bromopyridin-2-yl)-3-(2-phenylethyl)thiourea
Create Date: 2005-07-15
CID: 2429552

367. PT-103; Thiourea, N-(5-methyl-2-pyridinyl)-N'-(2-phenylethyl)-; 149486-00-0 ...
MW:     271.380580 g/mol MF: C15H17N3S
IUPAC name: 1-(5-methylpyridin-2-yl)-3-(2-phenylethyl)thiourea
Create Date: 2005-07-09
CID: 971434

368. AC1LARRG; Carbocyclic Analogue 64; CHEMBL53336 ...
MW:     298.377940 g/mol MF: C15H26N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-2-methyl-3-pentan-3-yloxycycl...
Create Date: 2005-08-01
CID: 493876

369. 2-(methylthio)pyrimidine-4,6(1H,5H)-dione; 2-methylsulfanyl-1H-pyrimidine-4,6-dione; 4,6(1h,5h)-pyrimidinedione, 2-(methylthio)- ...
MW:     158.178340 g/mol MF: C5H6N2O2S
IUPAC name: 2-methylsulfanyl-1H-pyrimidine-4,6-dione
Create Date: 2005-03-27
CID: 474186

370. B8L; 3-[(3-SEC-BUTYL-4-HYDROXYBENZOYL)AMINO]AZEPAN-4-YL 4-(2-HYDROXY-5-METHOXYBENZOYL)BENZOATE; BALANOL ANALOG 8 ...
MW:     560.637440 g/mol MF: C32H36N2O7
IUPAC name: [(3R,4R)-3-[[3-[(2S)-butan-2-yl]-4-hydroxybenzoyl]amino]azep...
Create Date: 2005-06-24
CID: 448327

371. 4-(1-Phenylcyclohexyl)morpholine; 1-(1-Phenylcyclohexyl)morpholine; Pcp morpholine analog ...
MW:     245.359920 g/mol MF: C16H23NO
IUPAC name: 4-(1-phenylcyclohexyl)morpholine
Create Date: 2005-03-27
CID: 121543

372. Tipranavir analog  7; AC1LAQW0; SCHEMBL7395596 ...
MW:     537.670300 g/mol MF: C29H35N3O5S
IUPAC name: N-[3-[(1R)-1-[(2R)-4-hydroxy-6-oxo-2-(2-phenylethyl)-2-propy...
Create Date: 2011-12-26
CID: 54682806

373. Lisinopril Cyclohexyl Analog; LP068346; I06-0003 ...
MW:     411.535580 g/mol MF: C21H37N3O5
IUPAC name: 1-[6-amino-2-[(1-carboxy-3-cyclohexylpropyl)amino]hexanoyl]p...
Create Date: 2009-06-17
CID: 42608880

374. N-alkoxysulfonamide analog 10; BDBM9170; N-alkoxysulfonamide analog entry j ...
MW:     689.777860 g/mol MF: C35H39N5O8S
IUPAC name: (2S)-N'-[(2S,3R)-4-[cyclopentyloxy-(4-methoxyphenyl)sulfonyl...
Create Date: 2008-01-19
CID: 23644609

375. CHEMBL17736; SB-203580 analogue 2; SCHEMBL2648969 ...
MW:     330.358303 g/mol MF: C20H15FN4
IUPAC name: 4-[4-(4-fluorophenyl)-5-pyridin-4-yl-1H-imidazol-2-yl]anilin...
Create Date: 2006-10-25
CID: 9902041

376. hydroxamate analogue 9; AC1O6ZZ6; BDBM8472 ...
MW:     396.461260 g/mol MF: C17H24N4O5S
IUPAC name: (2R)-N-hydroxy-2-[2-imidazol-1-ylethyl-(4-methoxyphenyl)sulf...
Create Date: 2006-05-10
CID: 6539657

377. hydroxamate analogue 8; AC1O6ZZ4; BDBM8471 ...
MW:     412.523560 g/mol MF: C18H24N2O5S2
IUPAC name: (2R)-N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(2-thiophen-3-yl...
Create Date: 2006-05-10
CID: 6539656

378. hydroxamate analogue 7; AC1O6ZZ2; BDBM8470 ...
MW:     393.457320 g/mol MF: C18H23N3O5S
IUPAC name: (2R)-N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(pyridin-4-ylmet...
Create Date: 2006-05-10
CID: 6539655

379. hydroxamate analogue 6; AC1O6ZZ0; BDBM8469 ...
MW:     278.249330 g/mol MF: C7H13F3N2O4S
IUPAC name: (2R)-N-hydroxy-3-methyl-2-(2,2,2-trifluoroethylsulfonylamino...
Create Date: 2006-05-10
CID: 6539654

380. hydroxamate analogue 5; AC1O6ZYY; BDBM8468 ...
MW:     286.304260 g/mol MF: C11H14N2O5S
IUPAC name: N-[(3R)-1-hydroxy-2-oxopyrrolidin-3-yl]-4-methoxybenzenesulf...
Create Date: 2006-05-10
CID: 6539653

381. hydroxamate analogue 3; AC1O6ZYW; BDBM8467 ...
MW:     265.308260 g/mol MF: C13H19N3O3
IUPAC name: (2R)-2-[acetyl(pyridin-3-ylmethyl)amino]-N-hydroxy-3-methylb...
Create Date: 2006-05-10
CID: 6539652

382. CHEMBL114272; hydroxamate analogue 2; AC1O6ZYU ...
MW:     302.346720 g/mol MF: C12H18N2O5S
IUPAC name: (2R)-N-hydroxy-2-[(4-methoxyphenyl)sulfonylamino]-3-methylbu...
Create Date: 2006-05-10
CID: 6539651

383. CHEMBL407981; pyrazolo[3,4-b]pyridine analogue 9; AC1O6ZV0 ...
MW:     487.392780 g/mol MF: C22H27BrN6O2
IUPAC name: N-[5-bromo-6-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,2-dihydro...
Create Date: 2006-05-10
CID: 6539582

384. CHEMBL259270; FE-0730; (5-Bromo-6-phenyl-1H-pyrazolo[3,4-b]pyridin-3-yl) cyclopropane carboxamide ...
MW:     357.204620 g/mol MF: C16H13BrN4O
IUPAC name: N-(5-bromo-6-phenyl-1H-pyrazolo[3,4-b]pyridin-3-yl)cycloprop...
Create Date: 2006-05-10
CID: 6539578

385. CHEMBL260417; SB-725317; AC1O6ZUK ...
MW:     373.204020 g/mol MF: C16H13BrN4O2
IUPAC name: N-[5-bromo-6-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,2-dihydro...
Create Date: 2006-05-10
CID: 6539574

386. CHEMBL427909; AC1O6ZUI; 6-aryl-pyrazolo[3,4-b]pyridine analogue 12 ...
MW:     370.403920 g/mol MF: C22H18N4O2
IUPAC name: N-[6-(4-oxocyclohexa-2,5-dien-1-ylidene)-5-phenyl-1,2-dihydr...
Create Date: 2006-05-10
CID: 6539573

387. Paullone Analogue 75; BDBM7340; CHEMBL119963 ...
MW:     299.304560 g/mol MF: C14H9N3O3S
Create Date: 2006-05-10
CID: 6538765

388. Paullone Analogue 74; BDBM7339; CHEMBL118162 ...
MW:     279.316460 g/mol MF: C15H9N3OS
Create Date: 2006-05-10
CID: 6538764

389. Paullone Analogue 73; BDBM7338; CHEMBL334031 ...
MW:     288.752060 g/mol MF: C14H9ClN2OS
Create Date: 2006-05-10
CID: 6538763

390. Paullone Analogue 72; BDBM7337; CHEMBL118406 ...
MW:     268.333580 g/mol MF: C15H12N2OS
Create Date: 2006-05-10
CID: 6538762

391. Paullone Analogue 69; AC1O6YMA; BDBM7334 ...
MW:     337.395600 g/mol MF: C18H15N3O2S
IUPAC name: 12-methyl-6-methylsulfanyl-9-nitro-7H-indolo[3,2-d][1]benzaz...
Create Date: 2006-05-10
CID: 6538758

392. Paullone Analogue 68; AC1O6YM8; BDBM7333 ...
MW:     309.342440 g/mol MF: C16H11N3O2S
IUPAC name: 9-nitro-7,12-dihydro-5H-indolo[3,2-d][1]benzazepine-6-thione
Create Date: 2006-05-10
CID: 6538757

393. Paullone Analogue 67; BDBM7332; CHEMBL331783 ...
MW:     249.267340 g/mol MF: C15H11N3O
Create Date: 2006-05-10
CID: 6538756

394. Paullone Analogue 66; BDBM7331; CHEMBL121953 ...
MW:     263.293920 g/mol MF: C16H13N3O
Create Date: 2006-05-10
CID: 6538755

395. Paullone Analogue 65; AC1O6YM6; BDBM7330 ...
MW:     323.302820 g/mol MF: C17H13N3O4
IUPAC name: 2-methoxy-9-nitro-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin...
Create Date: 2006-05-10
CID: 6538754

396. Paullone Analogue 64; AC1O6YM4; BDBM7329 ...
MW:     323.302820 g/mol MF: C17H13N3O4
IUPAC name: 3-methoxy-9-nitro-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin...
Create Date: 2006-05-10
CID: 6538753

397. Paullone Analogue 63; AC1O6YM2; BDBM7328 ...
MW:     303.314720 g/mol MF: C18H13N3O2
IUPAC name: 3-methoxy-6-oxo-7,12-dihydro-5H-indolo[3,2-d][1]benzazepine-...
Create Date: 2006-05-10
CID: 6538752

398. Paullone Analogue 62; BDBM7327; CHEMBL120078 ...
MW:     317.265310 g/mol MF: C16H10F3N3O
Create Date: 2006-05-10
CID: 6538751

399. Paullone Analogue 61; BDBM7326; CHEMBL331722 ...
MW:     283.712400 g/mol MF: C15H10ClN3O
Create Date: 2006-05-10
CID: 6538750

400. Paullone Analogue 60; AC1O6YM0; BDBM7325 ...
MW:     372.340510 g/mol MF: C20H15F3N2O2
IUPAC name: 2-(2-oxopropyl)-9-(trifluoromethyl)-7,12-dihydro-5H-indolo[3...
Create Date: 2006-05-10
CID: 6538749

401. Paullone Analogue 59; BDBM7324; CHEMBL120137 ...
MW:     279.293320 g/mol MF: C16H13N3O2
Create Date: 2006-05-10
CID: 6538748

402. Paullone Analogue 58; AC1O6YLY; BDBM7323 ...
MW:     305.330600 g/mol MF: C18H15N3O2
IUPAC name: N-(6-oxo-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-9-yl)ace...
Create Date: 2006-05-10
CID: 6538747

403. Paullone Analogue 57; AC1O6YLW; BDBM7322 ...
MW:     343.174740 g/mol MF: C16H11BrN2O2
IUPAC name: 9-bromo-3-hydroxy-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin...
Create Date: 2006-05-10
CID: 6538746

404. Paullone Analogue 56; AC1O6YLU; BDBM7321 ...
MW:     263.293920 g/mol MF: C16H13N3O
IUPAC name: 9-amino-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-one
Create Date: 2006-05-10
CID: 6538745

405. Paullone Analogue 55; AC1O6YLS; BDBM7320 ...
MW:     346.303230 g/mol MF: C18H13F3N2O2
IUPAC name: 3-methoxy-9-(trifluoromethyl)-7,12-dihydro-5H-indolo[3,2-d][...
Create Date: 2006-05-10
CID: 6538744

406. Paullone Analogue 54; AC1O6YLQ; BDBM7319 ...
MW:     273.288740 g/mol MF: C17H11N3O
IUPAC name: 6-oxo-7,12-dihydro-5H-indolo[3,2-d][1]benzazepine-2-carbonit...
Create Date: 2006-05-10
CID: 6538743

407. Paullone Analogue 53; AC1O6YLO; BDBM7318 ...
MW:     453.071870 g/mol MF: C16H10BrIN2O
IUPAC name: 9-bromo-2-iodo-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-...
Create Date: 2006-05-10
CID: 6538742

408. rapamycin; UNII-W36ZG6FT64; Rapammune ...
MW:     914.171860 g/mol MF: C51H79NO13
Create Date: 2006-04-28
CID: 6436030

409. N-alkoxysulfonamide analog 23; BDBM9182; CHEMBL362312 ...
MW:     632.721700 g/mol MF: C31H40N2O10S
IUPAC name: [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ...
Create Date: 2005-10-07
CID: 6321057

410. N-alkoxysulfonamide analog 22; BDBM9181; CHEMBL364424 ...
MW:     618.695120 g/mol MF: C30H38N2O10S
IUPAC name: [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ...
Create Date: 2005-10-07
CID: 6321056

411. N-alkoxysulfonamide analog 21; BDBM9180; CHEMBL361082 ...
MW:     590.685020 g/mol MF: C29H38N2O9S
IUPAC name: [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ...
Create Date: 2005-10-07
CID: 6321055

412. N-alkoxysulfonamide analog 20; BDBM9179; CHEMBL362524 ...
MW:     589.700260 g/mol MF: C29H39N3O8S
IUPAC name: [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ...
Create Date: 2005-10-07
CID: 6321054

413. N-alkoxysulfonamide analog 19; BDBM9178; CHEMBL362510 ...
MW:     589.700260 g/mol MF: C29H39N3O8S
IUPAC name: [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ...
Create Date: 2005-10-07
CID: 6321053

414. AC1O41ZY; N-alkoxysulfonamide analog 18; BDBM9177 ...
MW:     604.711600 g/mol MF: C30H40N2O9S
IUPAC name: [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ...
Create Date: 2005-10-07
CID: 6321052

415. AC1O41ZW; N-alkoxysulfonamide analog 17; BDBM9176 ...
MW:     618.695120 g/mol MF: C30H38N2O10S
IUPAC name: [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ...
Create Date: 2005-10-07
CID: 6321051

416. AC1O41ZU; N-alkoxysulfonamide analog 16; BDBM9175 ...
MW:     604.668540 g/mol MF: C29H36N2O10S
IUPAC name: [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ...
Create Date: 2005-10-07
CID: 6321050

417. AC1O41ZS; N-alkoxysulfonamide analog 15; BDBM9174 ...
MW:     576.658440 g/mol MF: C28H36N2O9S
IUPAC name: [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ...
Create Date: 2005-10-07
CID: 6321049

418. AC1O41ZQ; N-alkoxysulfonamide analog 14; BDBM9173 ...
MW:     575.673680 g/mol MF: C28H37N3O8S
IUPAC name: [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ...
Create Date: 2005-10-07
CID: 6321048

419. AC1O41ZO; N-alkoxysulfonamide analog 13; BDBM9172 ...
MW:     575.673680 g/mol MF: C28H37N3O8S
IUPAC name: [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ...
Create Date: 2005-10-07
CID: 6321047

420. AC1O41ZM; N-alkoxysulfonamide analog 11; BDBM9171 ...
MW:     590.685020 g/mol MF: C29H38N2O9S
IUPAC name: [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ...
Create Date: 2005-10-07
CID: 6321046

421. carbocyclic analog 19; AC1NS6JN; CHEMBL97199 ...
MW:     300.350760 g/mol MF: C14H24N2O5
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-[(3R)-1-hydroxypentan-3-yl]...
Create Date: 2006-01-30
CID: 5329319

422. carbocyclic analog 18; AC1NS6JH; CHEMBL96603 ...
MW:     314.334280 g/mol MF: C14H22N2O6
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-[(2S)-1-carboxybutan-2-yl]o...
Create Date: 2006-01-30
CID: 5329317

423. Rapamycin; Sirolimus; Rapamune ...
MW:     914.171860 g/mol MF: C51H79NO13
Create Date: 2005-06-24
CID: 5284616

424. Fentanyl propyl analog; AC1LDHKA; CKBFKWWOUYBCRH-UHFFFAOYSA-N ...
MW:     350.497100 g/mol MF: C23H30N2O
IUPAC name: N-phenyl-N-[1-(3-phenylpropyl)piperidin-4-yl]propanamide
Create Date: 2005-03-27
CID: 618626

425. Lantanilic acid analog; AC1LABSM; hydroxy-hexamethyl-(3-methylbut-2-enoxy)[?]carboxylic acid ...
MW:     554.800260 g/mol MF: C35H54O5
Create Date: 2005-08-01
CID: 485177

426. CHEMBL26752; PNU-142721 analog; AC1LAR0C ...
MW:     306.770640 g/mol MF: C13H11ClN4OS
IUPAC name: 6-chloro-2-[(1R)-1-furo[2,3-c]pyridin-5-ylethyl]sulfanylpyri...
Create Date: 2005-08-01
CID: 473448

427. Steriod-Peptide analog; AC1LAN0X
MW:    1708.044300 g/mol MF: C87H130N14O21
IUPAC name: (2S)-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[2-[[...
Create Date: 2005-08-01
CID: 471398

428. 4-amino-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one; d4C, thiophene analog; AC1LA6XT ...
MW:     225.267540 g/mol MF: C9H11N3O2S
IUPAC name: 4-amino-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-y...
Create Date: 2005-08-01
CID: 462828

429. 129779-72-2; AC1L9Q4X; .alpha.Pyranoid analog of AZT ...
MW:     281.267900 g/mol MF: C11H15N5O4
IUPAC name: 1-[(2S,4S,6S)-4-azido-6-(hydroxymethyl)oxan-2-yl]-5-methylpy...
Create Date: 2005-08-01
CID: 452178

430. CHEMBL280752; 6-chloro-2-(1-furo[2,3-c]pyridin-5-ylethylsulfanyl)pyrimidin-4-amine; PNU-142721 analog ...
MW:     306.770640 g/mol MF: C13H11ClN4OS
IUPAC name: 6-chloro-2-(1-furo[2,3-c]pyridin-5-ylethylsulfanyl)pyrimidin...
Create Date: 2005-03-25
CID: 1857

431. 1,1'-dibenzo[b,d]furan-2,8-diylbis[2-(dimethylamino)ethanone]; Tilorone analog 11,567; AC1L4NBT ...
MW:     338.400280 g/mol MF: C20H22N2O3
IUPAC name: 2-(dimethylamino)-1-[8-[2-(dimethylamino)acetyl]dibenzofuran...
Create Date: 2005-07-19
CID: 160261

432. Tipranavir analog  11; AC1LAQV0; SCHEMBL7207076 ...
MW:     559.675820 g/mol MF: C31H33N3O5S
IUPAC name: 5-cyano-N-[3-[(1R)-1-[(2R)-4-hydroxy-6-oxo-2-(2-phenylethyl)...
Create Date: 2011-12-26
CID: 54688873

433. hydroxamate analogue 51; AC1O701G; BDBM8514 ...
MW:     357.380523 g/mol MF: C14H18FN4O4S+
IUPAC name: (2R)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-hydroxy-4-...
Create Date: 2006-05-10
CID: 6539703

434. hydroxamate analogue 50; AC1O701E; BDBM8513 ...
MW:     362.400343 g/mol MF: C13H21FN5O4S+
IUPAC name: [N'-[(4R)-4-[(4-fluoro-3-methylphenyl)sulfonylamino]-5-(hydr...
Create Date: 2006-05-10
CID: 6539701

435. hydroxamate analogue 49; AC1O701C; BDBM8512 ...
MW:     336.359763 g/mol MF: C12H19FN3O5S+
IUPAC name: 2-[(2R)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]-3-(hydrox...
Create Date: 2006-05-10
CID: 6539699

436. hydroxamate analogue 48; AC1O701A; BDBM8511 ...
MW:     391.438263 g/mol MF: C15H24FN4O5S+
IUPAC name: [1-[[(3R)-3-[(4-fluoro-3-methylphenyl)sulfonylamino]-4-(hydr...
Create Date: 2006-05-10
CID: 6539697

437. hydroxamate analogue 47; BDBM8510; AC1O7018 ...
MW:     377.411683 g/mol MF: C14H22FN4O5S+
IUPAC name: [(2S)-1-[[(3R)-3-[(4-fluoro-3-methylphenyl)sulfonylamino]-4-...
Create Date: 2006-05-10
CID: 6539695

438. hydroxamate analogue 46; BDBM8509; AC1O7016 ...
MW:     363.385103 g/mol MF: C13H20FN4O5S+
IUPAC name: [2-[[(3R)-3-[(4-fluoro-3-methylphenyl)sulfonylamino]-4-(hydr...
Create Date: 2006-05-10
CID: 6539693

439. hydroxamate analogue 45; BDBM8508; CHEMBL202508 ...
MW:     330.375063 g/mol MF: C14H19FN2O4S
IUPAC name: (2R,3S)-3-cyclopropyl-2-[(4-fluoro-3-methylphenyl)sulfonylam...
Create Date: 2006-05-10
CID: 6539692

440. hydroxamate analogue 44; BDBM8507; CHEMBL203539 ...
MW:     316.348483 g/mol MF: C13H17FN2O4S
IUPAC name: (2R)-3-cyclopropyl-2-[(4-fluoro-3-methylphenyl)sulfonylamino...
Create Date: 2006-05-10
CID: 6539691

441. hydroxamate analogue 42; AC1O700Y; BDBM8505 ...
MW:     318.364363 g/mol MF: C13H19FN2O4S
IUPAC name: (2R,3S)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-hydroxy...
Create Date: 2006-05-10
CID: 6539689

442. hydroxamate analogue 41; AC1O700W; BDBM8504 ...
MW:     332.347883 g/mol MF: C13H17FN2O5S
IUPAC name: 2-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-hydroxy-2-(oxol...
Create Date: 2006-05-10
CID: 6539688

443. hydroxamate analogue 39; AC1O700U; BDBM8502 ...
MW:     338.354003 g/mol MF: C15H15FN2O4S
IUPAC name: (2R)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-hydroxy-2-...
Create Date: 2006-05-10
CID: 6539687

444. hydroxamate analogue 38; AC1O700S; BDBM8501 ...
MW:     344.401643 g/mol MF: C15H21FN2O4S
IUPAC name: (2R)-2-cyclohexyl-2-[(4-fluoro-3-methylphenyl)sulfonylamino]...
Create Date: 2006-05-10
CID: 6539686

445. hydroxamate analogue 37; AC1O700Q; BDBM8500 ...
MW:     330.375063 g/mol MF: C14H19FN2O4S
IUPAC name: (2R)-2-cyclopentyl-2-[(4-fluoro-3-methylphenyl)sulfonylamino...
Create Date: 2006-05-10
CID: 6539685

446. hydroxamate analogue 36; AC1O700O; BDBM8499 ...
MW:     316.348483 g/mol MF: C13H17FN2O4S
IUPAC name: (2R)-2-cyclobutyl-2-[(4-fluoro-3-methylphenyl)sulfonylamino]...
Create Date: 2006-05-10
CID: 6539684

447. hydroxamate analogue 35; AC1O700M; BDBM8498 ...
MW:     302.321903 g/mol MF: C12H15FN2O4S
IUPAC name: (2R)-2-cyclopropyl-2-[(4-fluoro-3-methylphenyl)sulfonylamino...
Create Date: 2006-05-10
CID: 6539683

448. hydroxamate analogue 34; AC1O700K; BDBM8497 ...
MW:     318.364363 g/mol MF: C13H19FN2O4S
IUPAC name: (2R)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-hydroxy-3,...
Create Date: 2006-05-10
CID: 6539682

449. hydroxamate analogue 33; AC1O700I; BDBM8496 ...
MW:     318.364363 g/mol MF: C13H19FN2O4S
IUPAC name: (2R)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-hydroxyhex...
Create Date: 2006-05-10
CID: 6539681

450. hydroxamate analogue 32; AC1O700G; BDBM8495 ...
MW:     290.311203 g/mol MF: C11H15FN2O4S
IUPAC name: (2R)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-hydroxybut...
Create Date: 2006-05-10
CID: 6539680

451. hydroxamate analogue 31; AC1O700E; BDBM8494 ...
MW:     276.284623 g/mol MF: C10H13FN2O4S
IUPAC name: (2R)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-hydroxypro...
Create Date: 2006-05-10
CID: 6539679

452. hydroxamate analogue 30; AC1O700C; BDBM8493 ...
MW:     362.448260 g/mol MF: C11H14N4O4S3
IUPAC name: (2R)-N-hydroxy-3-methyl-2-[[5-(thiadiazol-5-yl)thiophen-2-yl...
Create Date: 2006-05-10
CID: 6539678

453. hydroxamate analogue 29; AC1O700A; BDBM8492 ...
MW:     312.793520 g/mol MF: C9H13ClN2O4S2
IUPAC name: (2R)-2-[(5-chlorothiophen-2-yl)sulfonylamino]-N-hydroxy-3-me...
Create Date: 2006-05-10
CID: 6539677

454. hydroxamate analogue 28; BDBM8491; CHEMBL201620 ...
MW:     320.337183 g/mol MF: C12H17FN2O5S
IUPAC name: (2R)-2-[[4-fluoro-2-(hydroxymethyl)phenyl]sulfonylamino]-N-h...
Create Date: 2006-05-10
CID: 6539676

455. hydroxamate analogue 27; BDBM8490; CHEMBL383156 ...
MW:     320.337183 g/mol MF: C12H17FN2O5S
IUPAC name: (2R)-2-[[4-fluoro-3-(hydroxymethyl)phenyl]sulfonylamino]-N-h...
Create Date: 2006-05-10
CID: 6539675

456. hydroxamate analogue 26; BDBM8489; CHEMBL203538 ...
MW:     302.346720 g/mol MF: C12H18N2O5S
IUPAC name: (2R)-N-hydroxy-2-[(4-hydroxy-3-methylphenyl)sulfonylamino]-3...
Create Date: 2006-05-10
CID: 6539674

457. hydroxamate analogue 25; BDBM8488; CHEMBL380714 ...
MW:     340.369883 g/mol MF: C15H17FN2O4S
IUPAC name: (2R)-2-[(4-fluoronaphthalen-1-yl)sulfonylamino]-N-hydroxy-3-...
Create Date: 2006-05-10
CID: 6539673

458. hydroxamate analogue 24; BDBM8487; CHEMBL204807 ...
MW:     348.416700 g/mol MF: C17H20N2O4S
IUPAC name: (2R)-N-hydroxy-3-methyl-2-[(4-phenylphenyl)sulfonylamino]but...
Create Date: 2006-05-10
CID: 6539672

459. hydroxamate analogue 23; AC1O6ZZY; BDBM8486 ...
MW:     392.469260 g/mol MF: C19H24N2O5S
IUPAC name: (2R)-N-hydroxy-3-methyl-2-[(3-methyl-4-phenylmethoxyphenyl)s...
Create Date: 2006-05-10
CID: 6539671

460. hydroxamate analogue 21; AC1O6ZZU; BDBM8484 ...
MW:     344.426460 g/mol MF: C15H24N2O5S
IUPAC name: (2R)-2-[(4-butoxyphenyl)sulfonylamino]-N-hydroxy-3-methylbut...
Create Date: 2006-05-10
CID: 6539669

461. hydroxamate analogue 20; AC1O6ZZS; BDBM8483 ...
MW:     320.792380 g/mol MF: C12H17ClN2O4S
IUPAC name: (2R)-2-[(3-chlorophenyl)methylsulfonylamino]-N-hydroxy-3-met...
Create Date: 2006-05-10
CID: 6539668

462. hydroxamate analogue 19; AC1O6ZZQ; BDBM8482 ...
MW:     300.373900 g/mol MF: C13H20N2O4S
IUPAC name: (2R)-N-hydroxy-3-methyl-2-(2-phenylethylsulfonylamino)butana...
Create Date: 2006-05-10
CID: 6539667

463. hydroxamate analogue 18; AC1O6ZZO; BDBM8481 ...
MW:     304.337783 g/mol MF: C12H17FN2O4S
IUPAC name: (2R)-2-[(3-fluoro-4-methylphenyl)sulfonylamino]-N-hydroxy-3-...
Create Date: 2006-05-10
CID: 6539666

464. hydroxamate analogue 17; AC1O6ZZM; BDBM8480 ...
MW:     340.318710 g/mol MF: C12H15F3N2O4S
IUPAC name: (2R)-N-hydroxy-3-methyl-2-[[4-(trifluoromethyl)phenyl]sulfon...
Create Date: 2006-05-10
CID: 6539665

465. hydroxamate analogue 16; AC1O6ZZK; BDBM8479 ...
MW:     304.337783 g/mol MF: C12H17FN2O4S
IUPAC name: (2R)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-hydroxy-3-...
Create Date: 2006-05-10
CID: 6539664

466. hydroxamate analogue 15; AC1O6ZZI; BDBM8478 ...
MW:     286.347320 g/mol MF: C12H18N2O4S
IUPAC name: (2R)-N-hydroxy-3-methyl-2-[(3-methylphenyl)sulfonylamino]but...
Create Date: 2006-05-10
CID: 6539663

467. hydroxamate analogue 14; AC1O6ZZG; BDBM8477 ...
MW:     286.347320 g/mol MF: C12H18N2O4S
IUPAC name: (2R)-N-hydroxy-3-methyl-2-[(4-methylphenyl)sulfonylamino]but...
Create Date: 2006-05-10
CID: 6539662

468. hydroxamate analogue 13; AC1O6ZZE; BDBM8476 ...
MW:     290.311203 g/mol MF: C11H15FN2O4S
IUPAC name: (2R)-2-[(4-fluorophenyl)sulfonylamino]-N-hydroxy-3-methylbut...
Create Date: 2006-05-10
CID: 6539661

469. hydroxamate analogue 12; AC1O6ZZC; BDBM8475 ...
MW:     290.311203 g/mol MF: C11H15FN2O4S
IUPAC name: (2R)-2-[(3-fluorophenyl)sulfonylamino]-N-hydroxy-3-methylbut...
Create Date: 2006-05-10
CID: 6539660

470. hydroxamate analogue 11; AC1O6ZZA; BDBM8474 ...
MW:     290.311203 g/mol MF: C11H15FN2O4S
IUPAC name: (2R)-2-[(2-fluorophenyl)sulfonylamino]-N-hydroxy-3-methylbut...
Create Date: 2006-05-10
CID: 6539659

471. hydroxamate analogue 10; AC1O6ZZ8; BDBM8473 ...
MW:     272.320740 g/mol MF: C11H16N2O4S
IUPAC name: (2R)-2-(benzenesulfonamido)-N-hydroxy-3-methylbutanamide
Create Date: 2006-05-10
CID: 6539658

472. Azo analog II; AC1O5QWT; 9,11-Azo-pgh2 ...
MW:     348.479680 g/mol MF: C20H32N2O3
IUPAC name: (Z)-7-[(1R,4S,5R,6R)-5-[(E,3S)-3-hydroxyoct-1-enyl]-2,3-diaz...
Create Date: 2006-04-28
CID: 6439069

473. CHEMBL365448; isoindolinone analog 27; AC1NS7WZ ...
MW:     431.483700 g/mol MF: C25H25N3O4
IUPAC name: 1-[4-[7-(2-methoxyethoxy)-1-oxo-2,3-dihydroisoindol-4-yl]phe...
Create Date: 2006-01-30
CID: 5329915

474. CHEMBL184223; isoindolinone analog 26; AC1NS7WW ...
MW:     387.431140 g/mol MF: C23H21N3O3
IUPAC name: 1-[4-(7-methoxy-1-oxo-2,3-dihydroisoindol-4-yl)phenyl]-3-(3-...
Create Date: 2006-01-30
CID: 5329914

475. CHEMBL359947; isoindolinone analog 14d; AC1NS7WT ...
MW:     457.524280 g/mol MF: C26H27N5O3
IUPAC name: 2-(dimethylamino)-N-[7-[4-[(3-methylphenyl)carbamoylamino]ph...
Create Date: 2006-01-30
CID: 5329913

476. CHEMBL184274; isoindolinone analog 14c; AC1NS7WQ ...
MW:     477.513920 g/mol MF: C28H23N5O3
IUPAC name: N-[7-[4-[(3-methylphenyl)carbamoylamino]phenyl]-3-oxo-1,2-di...
Create Date: 2006-01-30
CID: 5329912

477. CHEMBL183025; isoindolinone analog 14b; AC1NS7WN ...
MW:     476.525860 g/mol MF: C29H24N4O3
IUPAC name: N-[7-[4-[(3-methylphenyl)carbamoylamino]phenyl]-3-oxo-1,2-di...
Create Date: 2006-01-30
CID: 5329911

478. CHEMBL184021; isoindolinone analog 14a; AC1NS7WK ...
MW:     414.456480 g/mol MF: C24H22N4O3
IUPAC name: N-[7-[4-[(3-methylphenyl)carbamoylamino]phenyl]-3-oxo-1,2-di...
Create Date: 2006-01-30
CID: 5329910

479. CHEMBL183803; isoindolinone analog 13; AC1NS7WH ...
MW:     372.419800 g/mol MF: C22H20N4O2
IUPAC name: 1-[4-(7-amino-1-oxo-2,3-dihydroisoindol-4-yl)phenyl]-3-(3-me...
Create Date: 2006-01-30
CID: 5329909

480. CHEMBL185207; isoindolinone analog 10j; AC1NS7WE ...
MW:     385.458320 g/mol MF: C24H23N3O2
IUPAC name: 1-[2,6-dimethyl-4-(1-oxo-2,3-dihydroisoindol-4-yl)phenyl]-3-...
Create Date: 2006-01-30
CID: 5329908

481. CHEMBL184604; isoindolinone analog 10i; AC1NS7WB ...
MW:     385.458320 g/mol MF: C24H23N3O2
IUPAC name: 1-[2-ethyl-4-(1-oxo-2,3-dihydroisoindol-4-yl)phenyl]-3-(3-me...
Create Date: 2006-01-30
CID: 5329907

482. CHEMBL185522; isoindolinone analog 10h; AC1NS7W8 ...
MW:     391.850220 g/mol MF: C22H18ClN3O2
IUPAC name: 1-[2-chloro-4-(1-oxo-2,3-dihydroisoindol-4-yl)phenyl]-3-(3-m...
Create Date: 2006-01-30
CID: 5329906

483. CHEMBL185614; isoindolinone analog 10g; AC1NS7W5 ...
MW:     391.850220 g/mol MF: C22H18ClN3O2
IUPAC name: 1-[3-chloro-4-(1-oxo-2,3-dihydroisoindol-4-yl)phenyl]-3-(3-m...
Create Date: 2006-01-30
CID: 5329905

484. CHEMBL183174; isoindolinone analog 10f; AC1NS7W2 ...
MW:     425.403130 g/mol MF: C23H18F3N3O2
IUPAC name: 1-(3-methylphenyl)-3-[4-(1-oxo-2,3-dihydroisoindol-4-yl)-2-(...
Create Date: 2006-01-30
CID: 5329904

485. CHEMBL185059; isoindolinone analog 10e; AC1NS7VZ ...
MW:     425.403130 g/mol MF: C23H18F3N3O2
IUPAC name: 1-(3-methylphenyl)-3-[4-(1-oxo-2,3-dihydroisoindol-4-yl)-3-(...
Create Date: 2006-01-30
CID: 5329903

486. CHEMBL183844; isoindolinone analog 10d; Kinome_567 ...
MW:     371.431740 g/mol MF: C23H21N3O2
IUPAC name: 1-[2-methyl-4-(1-oxo-2,3-dihydroisoindol-4-yl)phenyl]-3-(3-m...
Create Date: 2006-01-30
CID: 5329902

487. CHEMBL185331; isoindolinone analog 10c; AC1NS7VT ...
MW:     371.431740 g/mol MF: C23H21N3O2
IUPAC name: 1-[3-methyl-4-(1-oxo-2,3-dihydroisoindol-4-yl)phenyl]-3-(3-m...
Create Date: 2006-01-30
CID: 5329901

488. CHEMBL184706; isoindolinone analog 10b; AC1NS7VQ ...
MW:     375.395623 g/mol MF: C22H18FN3O2
IUPAC name: 1-[2-fluoro-4-(1-oxo-2,3-dihydroisoindol-4-yl)phenyl]-3-(3-m...
Create Date: 2006-01-30
CID: 5329900

489. CHEMBL185197; isoindolinone analog 10a; AC1NS7VN ...
MW:     375.395623 g/mol MF: C22H18FN3O2
IUPAC name: 1-[3-fluoro-4-(1-oxo-2,3-dihydroisoindol-4-yl)phenyl]-3-(3-m...
Create Date: 2006-01-30
CID: 5329899

490. CHEMBL184170; isoindolinone analog 4o; AC1NS7VK ...
MW:     429.367013 g/mol MF: C22H15F4N3O2
IUPAC name: 1-[2-fluoro-5-(trifluoromethyl)phenyl]-3-[4-(1-oxo-2,3-dihyd...
Create Date: 2006-01-30
CID: 5329898

491. CHEMBL427139; isoindolinone analog 4n; AC1NS7VH ...
MW:     383.442440 g/mol MF: C24H21N3O2
IUPAC name: 1-(2,3-dihydro-1H-inden-5-yl)-3-[4-(1-oxo-2,3-dihydroisoindo...
Create Date: 2006-01-30
CID: 5329897

492. CHEMBL184226; isoindolinone analog 4m; AC1NS7VE ...
MW:     371.431740 g/mol MF: C23H21N3O2
IUPAC name: 1-(3,5-dimethylphenyl)-3-[4-(1-oxo-2,3-dihydroisoindol-4-yl)...
Create Date: 2006-01-30
CID: 5329896

493. CHEMBL184847; isoindolinone analog 4l; Kinome_586 ...
MW:     371.431740 g/mol MF: C23H21N3O2
IUPAC name: 1-(3,4-dimethylphenyl)-3-[4-(1-oxo-2,3-dihydroisoindol-4-yl)...
Create Date: 2006-01-30
CID: 5329895

494. CHEMBL184143; isoindolinone analog 4k; AC1NS7V8 ...
MW:     368.388040 g/mol MF: C22H16N4O2
IUPAC name: 1-(3-cyanophenyl)-3-[4-(1-oxo-2,3-dihydroisoindol-4-yl)pheny...
Create Date: 2006-01-30
CID: 5329894

495. CHEMBL360032; isoindolinone analog 4j; AC1NS7V5 ...
MW:     373.404560 g/mol MF: C22H19N3O3
IUPAC name: 1-(3-methoxyphenyl)-3-[4-(1-oxo-2,3-dihydroisoindol-4-yl)phe...
Create Date: 2006-01-30
CID: 5329893

496. CHEMBL182648; isoindolinone analog 4i; AC1NS7V2 ...
MW:     361.369043 g/mol MF: C21H16FN3O2
IUPAC name: 1-(3-fluorophenyl)-3-[4-(1-oxo-2,3-dihydroisoindol-4-yl)phen...
Create Date: 2006-01-30
CID: 5329892

497. CHEMBL427321; isoindolinone analog 4h; AC1NS7UZ ...
MW:     371.431740 g/mol MF: C23H21N3O2
IUPAC name: 1-(3-ethylphenyl)-3-[4-(1-oxo-2,3-dihydroisoindol-4-yl)pheny...
Create Date: 2006-01-30
CID: 5329891

498. CHEMBL182468; isoindolinone analog 4g; AC1NS7UW ...
MW:     377.823640 g/mol MF: C21H16ClN3O2
IUPAC name: 1-(3-chlorophenyl)-3-[4-(1-oxo-2,3-dihydroisoindol-4-yl)phen...
Create Date: 2006-01-30
CID: 5329890

499. CHEMBL364626; isoindolinone analog 4f; AC1NS7UT ...
MW:     411.376550 g/mol MF: C22H16F3N3O2
IUPAC name: 1-[4-(1-oxo-2,3-dihydroisoindol-4-yl)phenyl]-3-[4-(trifluoro...
Create Date: 2006-01-30
CID: 5329889

500. CHEMBL410711; isoindolinone analog 4e; AC1NS7UQ ...
MW:     411.376550 g/mol MF: C22H16F3N3O2
IUPAC name: 1-[4-(1-oxo-2,3-dihydroisoindol-4-yl)phenyl]-3-[3-(trifluoro...
Create Date: 2006-01-30
CID: 5329888

501. CHEMBL181654; isoindolinone analog 4d; AC1NS7UN ...
MW:     357.405160 g/mol MF: C22H19N3O2
IUPAC name: 1-(4-methylphenyl)-3-[4-(1-oxo-2,3-dihydroisoindol-4-yl)phen...
Create Date: 2006-01-30
CID: 5329887

502. CHEMBL360724; isoindolinone analog 4c; AC1NS7UK ...
MW:     357.405160 g/mol MF: C22H19N3O2
IUPAC name: 1-(2-methylphenyl)-3-[4-(1-oxo-2,3-dihydroisoindol-4-yl)phen...
Create Date: 2006-01-30
CID: 5329886

503. CHEMBL183051; isoindolinone analog 21; AC1NS7UH ...
MW:     373.470760 g/mol MF: C22H19N3OS
IUPAC name: 1-(3-methylphenyl)-3-[4-(1-oxo-2,3-dihydroisoindol-4-yl)phen...
Create Date: 2006-01-30
CID: 5329885

504. CHEMBL183580; isoindolinone analog 20; AC1NS7UE ...
MW:     356.417100 g/mol MF: C23H20N2O2
IUPAC name: 2-(3-methylphenyl)-N-[4-(1-oxo-2,3-dihydroisoindol-4-yl)phen...
Create Date: 2006-01-30
CID: 5329884

505. CHEMBL359795; isoindolinone analog 19; AC1NS7UB ...
MW:     356.417100 g/mol MF: C23H20N2O2
IUPAC name: N-(3-methylphenyl)-2-[4-(1-oxo-2,3-dihydroisoindol-4-yl)phen...
Create Date: 2006-01-30
CID: 5329883

506. CHEMBL184918; isoindolinone analog 18; AC1NS7U8 ...
MW:     371.431740 g/mol MF: C23H21N3O2
IUPAC name: 1-methyl-1-(3-methylphenyl)-3-[4-(1-oxo-2,3-dihydroisoindol-...
Create Date: 2006-01-30
CID: 5329882

507. CHEMBL184997; isoindolinone analog 17; AC1NS7U5 ...
MW:     371.431740 g/mol MF: C23H21N3O2
IUPAC name: 1-methyl-3-(3-methylphenyl)-1-[4-(1-oxo-2,3-dihydroisoindol-...
Create Date: 2006-01-30
CID: 5329881

508. CHEMBL185569; isoindolinone analog 4b; Kinome_529 ...
MW:     357.405160 g/mol MF: C22H19N3O2
IUPAC name: 1-(3-methylphenyl)-3-[4-(1-oxo-2,3-dihydroisoindol-4-yl)phen...
Create Date: 2006-01-30
CID: 5329880

509. CHEMBL185387; isoindolinone analog 16; AC1NS7TZ ...
MW:     364.417640 g/mol MF: C20H16N2O3S
IUPAC name: N-[4-(1-oxo-2,3-dihydroisoindol-4-yl)phenyl]benzenesulfonami...
Create Date: 2006-01-30
CID: 5329879

510. CHEMBL361285; isoindolinone analog 15; AC1NS7TW ...
MW:     328.363940 g/mol MF: C21H16N2O2
IUPAC name: N-[4-(1-oxo-2,3-dihydroisoindol-4-yl)phenyl]benzamide
Create Date: 2006-01-30
CID: 5329878

511. CHEMBL185477; isoindolinone analog 4a; AC1NS7TT ...
MW:     343.378580 g/mol MF: C21H17N3O2
IUPAC name: 1-[4-(1-oxo-2,3-dihydroisoindol-4-yl)phenyl]-3-phenylurea
Create Date: 2006-01-30
CID: 5329877

512. SU5416 analog 5c; AC1NS62D; BDBM4812 ...
MW:     378.510500 g/mol MF: C23H30N4O
IUPAC name: (3Z)-3-[[3,5-dimethyl-4-[3-(4-methylpiperazin-1-yl)propyl]-1...
Create Date: 2006-01-30
CID: 5329100

513. (2R)-2-{[(4-FLUORO-3-METHYLPHENYL)SULFONYL]AMINO}-N-HYDROXY-2-TETRAHYDRO-2H-PYRAN-4-YLACETAMIDE; hydroxamate analogue 40; 1yqy ...
MW:     346.374463 g/mol MF: C14H19FN2O5S
IUPAC name: (2R)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-hydroxy-2-...
Create Date: 2005-09-14
CID: 4369384

514. Propanamide, N-(3-fluorophenyl)-N-[1-(2-phenylethyl)-4-piperidinyl]-; 90736-22-4; 3-Fluorofentanyl analog ...
MW:     354.460983 g/mol MF: C22H27FN2O
IUPAC name: N-(3-fluorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propan...
Create Date: 2005-03-27
CID: 621847

515. CHEMBL57426; Benzoic Acid Analog 8; AC1LA2I6 ...
MW:     292.290540 g/mol MF: C13H16N4O4
IUPAC name: 3-(diaminomethylideneamino)-4-[2-(hydroxymethyl)-5-oxopyrrol...
Create Date: 2005-08-01
CID: 506046

516. CHEMBL292232; Benzoic Acid Analog 7; 3-guanidino-4-(2-oxopyrrolidin-1-yl)benzoic acid ...
MW:     262.264560 g/mol MF: C12H14N4O3
IUPAC name: 3-(diaminomethylideneamino)-4-(2-oxopyrrolidin-1-yl)benzoic ...
Create Date: 2005-08-01
CID: 506045

517. Carbocyclic Analogue 62; AC1LARRA; BDBM5012 ...
MW:     312.364760 g/mol MF: C14H24N4O4
IUPAC name: (3R,4R,5S)-4-acetamido-3-[(2S)-butan-2-yl]oxy-5-(diaminometh...
Create Date: 2005-08-01
CID: 493874

518. Carbocyclic Analogue 53; AC1LARQP; CHEMBL81286 ...
MW:     360.447320 g/mol MF: C20H28N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-[(3S)-1-phenylpentan-3-yl]o...
Create Date: 2005-08-01
CID: 493867

519. Carbocyclic Analogue 45; AC1LARQ7; BDBM4995 ...
MW:     296.362060 g/mol MF: C15H24N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-[(3S)-hex-5-en-3-yl]oxycycl...
Create Date: 2005-08-01
CID: 493859

520. Carbocyclic Analogue 43; AC1LA29G; BDBM4992 ...
MW:     270.324780 g/mol MF: C13H22N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-[(2R)-butan-2-yl]oxycyclohe...
Create Date: 2005-08-01
CID: 480261

521. IsoquinCON Urethane analog; AC1LA3G3; CHEMBL326258 ...
MW:     557.721380 g/mol MF: C31H47N3O6
IUPAC name: 3,4,5,6a-tetrahydro-2H-furo[2,3-b]furan-3a-yl N-[(2S,3R)-4-[...
Create Date: 2005-08-01
CID: 461024

522. Pterocarpan 9iBuO analog; AC1L9RXL; ACMC-20ay08 ...
MW:     342.385680 g/mol MF: C20H22O5
IUPAC name: 3-methoxy-9-(2-methylpropoxy)-6a,11a-dihydro-6H-[1]benzofuro...
Create Date: 2005-08-01
CID: 454887

523. BMS-740808 Analogue 6a; CHEMBL211410; SCHEMBL8359229 ...
MW:     546.543010 g/mol MF: C29H25F3N6O2
IUPAC name: 1-(3-amino-1,2-benzoxazol-5-yl)-6-[4-[2-[(dimethylamino)meth...
Create Date: 2007-12-05
CID: 22086976

524. Flavopiridol analogue 26; AC1NS7H2; BDBM5717 ...
MW:     374.430840 g/mol MF: C20H26N2O5
IUPAC name: 5,7-dihydroxy-8-(3-hydroxy-1-methylpiperidin-4-yl)-2-piperid...
Create Date: 2006-01-30
CID: 5329721

525. Flavopiridol analogue 25; AC1NS7GZ; BDBM5716 ...
MW:     382.409780 g/mol MF: C21H22N2O5
IUPAC name: 2-anilino-5,7-dihydroxy-8-(3-hydroxy-1-methylpiperidin-4-yl)...
Create Date: 2006-01-30
CID: 5329720

526. CHEMBL323015; Flavopiridol analogue 24; AC1NS7GW ...
MW:     429.489420 g/mol MF: C21H23N3O5S
IUPAC name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-5,7-dihydroxy-8-(3-hy...
Create Date: 2006-01-30
CID: 5329719

527. CHEMBL112582; Flavopiridol analogue 23; AC1NS7GT ...
MW:     379.470500 g/mol MF: C19H25NO5S
IUPAC name: 2-tert-butylsulfanyl-5,7-dihydroxy-8-(3-hydroxy-1-methylpipe...
Create Date: 2006-01-30
CID: 5329718

528. CHEMBL112050; Flavopiridol analogue 22; AC1NS7GQ ...
MW:     399.460140 g/mol MF: C21H21NO5S
IUPAC name: 5,7-dihydroxy-8-(3-hydroxy-1-methylpiperidin-4-yl)-2-phenyls...
Create Date: 2006-01-30
CID: 5329717

529. Flavopiridol analogue 18; AC1NS7GK; BDBM5711 ...
MW:     417.839600 g/mol MF: C21H20ClNO6
IUPAC name: 2-(2-chlorophenoxy)-5,7-dihydroxy-8-[(3S,4R)-3-hydroxy-1-met...
Create Date: 2006-01-30
CID: 5329715

530. Flavopiridol analogue 16; AC1NS7GH; BDBM5710 ...
MW:     433.905200 g/mol MF: C21H20ClNO5S
IUPAC name: 2-(2-chlorophenyl)sulfanyl-5,7-dihydroxy-8-[(3S,4R)-3-hydrox...
Create Date: 2006-01-30
CID: 5329714

531. CHEMBL326843; Flavopiridol analogue 19; AC1NS7GE ...
MW:     351.417340 g/mol MF: C17H21NO5S
IUPAC name: 2-ethylsulfanyl-5,7-dihydroxy-8-(3-hydroxy-1-methylpiperidin...
Create Date: 2006-01-30
CID: 5329713

532. Acyclic Balanol Analog 8b; AC1NS3FH; BDBM3190 ...
MW:     571.530900 g/mol MF: C31H25NO10
IUPAC name: 2-[4-[2-benzamido-3-(4-hydroxyphenyl)propoxy]carbonyl-2,6-di...
Create Date: 2006-01-30
CID: 5327950

533. Acyclic Balanol Analog 7b; AC1NS3FE; BDBM3188 ...
MW:     545.515220 g/mol MF: C25H23NO11S
IUPAC name: 2-[2,6-dihydroxy-4-[3-(4-hydroxyphenyl)-2-(methanesulfonamid...
Create Date: 2006-01-30
CID: 5327949

534. Acyclic Balanol Analog 6b; AC1NS3F5; BDBM3185 ...
MW:     607.584600 g/mol MF: C30H25NO11S
IUPAC name: 2-[4-[2-(benzenesulfonamido)-3-(4-hydroxyphenyl)propoxy]carb...
Create Date: 2006-01-30
CID: 5327946

535. Acyclic Balanol Analog 3; AC1NS3EW; BDBM3181 ...
MW:     481.408360 g/mol MF: C24H19NO10
IUPAC name: 2-[2,6-dihydroxy-4-[2-[(4-hydroxybenzoyl)amino]ethoxycarbony...
Create Date: 2006-01-30
CID: 5327943

536. 4-amino-5-fluoro-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one; 5Fd4C, thiophene analog; AC1LA6XW ...
MW:     243.258003 g/mol MF: C9H10FN3O2S
IUPAC name: 4-amino-5-fluoro-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrothi...
Create Date: 2005-08-01
CID: 462829

537. MDL 73,669 analog; Difluorostatone mimetic; AC1L9UA9 ...
MW:     544.547106 g/mol MF: C27H30F2N4O6
IUPAC name: N-benzyl-2,2-difluoro-3-oxo-3-[(3S)-5,8,11-trioxo-6-propan-2...
Create Date: 2005-08-01
CID: 456118

538. Pterocarpan 9cHexO analog; ACMC-20c1uq; AC1L9RXM ...
MW:     382.449540 g/mol MF: C23H26O5
IUPAC name: 9-(cyclohexylmethoxy)-3-methoxy-6a,11a-dihydro-6H-[1]benzofu...
Create Date: 2005-08-01
CID: 454888

539. O,O-dimethyl S-(((4-chlorophenyl)thio)methyl) phosphorothioate; 7332-32-3; PO-Methyl trithion ...
MW:     298.746542 g/mol MF: C9H12ClO3PS2
IUPAC name: 1-chloro-4-(dimethoxyphosphorylsulfanylmethylsulfanyl)benzen...
Create Date: 2005-08-08
CID: 81778

540. Acetamide, N-(3-cyano-4,5-dimethyl-1H-pyrrol-2-yl)-2-(diethylamino)-, monohydrochloride; Methyl nitrile lidocaine analog; AC1L4TFF ...
MW:     284.785040 g/mol MF: C13H21ClN4O
IUPAC name: N-(3-cyano-4,5-dimethyl-1H-pyrrol-2-yl)-2-(diethylamino)acet...
Create Date: 2005-08-09
CID: 191932

541. Thiocolchicoside; Coltramyl; 602-41-5 ...
MW:     563.616620 g/mol MF: C27H33NO10S
IUPAC name: N-[(7S)-1,2-dimethoxy-10-methylsulfanyl-9-oxo-3-[(2S,3R,4S,5...
Create Date: 2006-10-25
CID: 9915886

542. PD089828 analog 9; AC1NS63J; BDBM4828 ...
MW:     449.732120 g/mol MF: C18H18BrClN6O
IUPAC name: 1-[2-amino-6-(2-bromo-6-chlorophenyl)pyrido[2,3-d]pyrimidin-...
Create Date: 2006-01-30
CID: 5329114

543. PD089828 analog 7; AC1NS63G; BDBM4826 ...
MW:     439.726180 g/mol MF: C18H17Cl3N6O
IUPAC name: 1-[2-amino-6-(2,3,6-trichlorophenyl)pyrido[2,3-d]pyrimidin-7...
Create Date: 2006-01-30
CID: 5329113

544. PD089828 analog 6; AC1NS63D; CHEMBL79274 ...
MW:     405.281120 g/mol MF: C18H18Cl2N6O
IUPAC name: 1-[2-amino-6-(2,3-dichlorophenyl)pyrido[2,3-d]pyrimidin-7-yl...
Create Date: 2006-01-30
CID: 5329112

545. CHEMBL76599; PD089828 analog 4; AC1NS63A ...
MW:     336.391000 g/mol MF: C18H20N6O
IUPAC name: 1-(2-amino-6-phenylpyrido[2,3-d]pyrimidin-7-yl)-3-tert-butyl...
Create Date: 2006-01-30
CID: 5329111

546. SU11248 analog 12j; AC1NS637; BDBM4822 ...
MW:     394.402263 g/mol MF: C20H19FN6O2
IUPAC name: 5-[(Z)-(5-fluoro-2-oxo-1H-indol-3-ylidene)methyl]-2,4-dimeth...
Create Date: 2006-01-30
CID: 5329110

547. SU11248 analog 12i; AC1NS634; BDBM4821 ...
MW:     390.410263 g/mol MF: C22H19FN4O2
IUPAC name: 5-[(Z)-(5-fluoro-2-oxo-1H-indol-3-ylidene)methyl]-2,4-dimeth...
Create Date: 2006-01-30
CID: 5329109

548. SU11248 analog 12h; CHEMBL13354; AC1NS631 ...
MW:     412.457303 g/mol MF: C22H25FN4O3
IUPAC name: 5-[(Z)-(5-fluoro-2-oxo-1H-indol-3-ylidene)methyl]-2,4-dimeth...
Create Date: 2006-01-30
CID: 5329108

549. SU11248 analog 12g; AC1NS62Y; CHEMBL13983 ...
MW:     410.484483 g/mol MF: C23H27FN4O2
IUPAC name: 5-[(Z)-(5-fluoro-2-oxo-1H-indol-3-ylidene)methyl]-2,4-dimeth...
Create Date: 2006-01-30
CID: 5329107

550. Toceranib; 356068-94-5; UNII-59L7Y0530C ...
MW:     396.457903 g/mol MF: C22H25FN4O2
IUPAC name: 5-[(Z)-(5-fluoro-2-oxo-1H-indol-3-ylidene)methyl]-2,4-dimeth...
Create Date: 2006-01-30
CID: 5329106

551. N,N-Dimethyl Sunitinib; SU11248 analog 12e; 326914-17-4 ...
MW:     370.420623 g/mol MF: C20H23FN4O2
IUPAC name: N-[2-(dimethylamino)ethyl]-5-[(Z)-(5-fluoro-2-oxo-1H-indol-3...
Create Date: 2006-01-30
CID: 5329105

552. SU11248 analog 12d; AC1NS62P; CHEMBL13629 ...
MW:     459.379380 g/mol MF: C22H27BrN4O2
IUPAC name: 5-[(Z)-(5-bromo-2-oxo-1H-indol-3-ylidene)methyl]-N-[2-(dieth...
Create Date: 2006-01-30
CID: 5329104

553. SU11248 analog 12a; AC1NS62G; BDBM4813 ...
MW:     380.483320 g/mol MF: C22H28N4O2
IUPAC name: N-[2-(diethylamino)ethyl]-2,4-dimethyl-5-[(Z)-(2-oxo-1H-indo...
Create Date: 2006-01-30
CID: 5329101

554. Acyclic Balanol Analog 21c; AC1NS3GK; BDBM3204 ...
MW:     466.436780 g/mol MF: C25H22O9
IUPAC name: 3-(4-hydroxyphenyl)propyl 3,5-dihydroxy-4-(2-hydroxy-6-metho...
Create Date: 2006-01-30
CID: 5327963

555. Acyclic Balanol Analog 39b; AC1NS3GE; BDBM3202 ...
MW:     494.446880 g/mol MF: C26H22O10
IUPAC name: 2-[2,6-dihydroxy-4-[(1R,2R)-2-(4-hydroxyphenoxy)cyclopentyl]...
Create Date: 2006-01-30
CID: 5327961

556. Acyclic Balanol Analog 35b; AC1NS3GB; BDBM3201 ...
MW:     493.462120 g/mol MF: C26H23NO9
IUPAC name: 2-[2,6-dihydroxy-4-[(3S,4R)-4-[(4-hydroxyphenyl)methyl]pyrro...
Create Date: 2006-01-30
CID: 5327960

557. Acyclic Balanol Analog 30b; AC1NS3G8; BDBM3200 ...
MW:     492.474060 g/mol MF: C27H24O9
IUPAC name: 2-[2,6-dihydroxy-4-[(1R,2R)-2-[(4-hydroxyphenyl)methyl]cyclo...
Create Date: 2006-01-30
CID: 5327959

558. Acyclic Balanol Analog 22b; AC1NS3G2; BDBM3198 ...
MW:     466.436780 g/mol MF: C25H22O9
IUPAC name: 2-[2,6-dihydroxy-4-[4-(4-hydroxyphenyl)butoxycarbonyl]benzoy...
Create Date: 2006-01-30
CID: 5327957

559. Acyclic Balanol Analog 26b; AC1NS3FZ; BDBM3197 ...
MW:     623.584000 g/mol MF: C30H25NO12S
IUPAC name: 2-[4-[2-(benzenesulfonamido)-3-(4-hydroxyphenoxy)propoxy]car...
Create Date: 2006-01-30
CID: 5327956

560. Acyclic Balanol Analog 13b; AC1NS3FW; BDBM3196 ...
MW:     593.558020 g/mol MF: C29H23NO11S
IUPAC name: 2-[4-[2-(benzenesulfonamido)-2-(4-hydroxyphenyl)ethoxy]carbo...
Create Date: 2006-01-30
CID: 5327955

561. Acyclic Balanol Analog 17b; AC1NS3FT; BDBM3194 ...
MW:     587.530300 g/mol MF: C31H25NO11
IUPAC name: 2-[2,6-dihydroxy-4-[2-[(4-hydroxybenzoyl)amino]-3-(4-hydroxy...
Create Date: 2006-01-30
CID: 5327954

562. Acyclic Balanol Analog 21b; AC1NS3FQ; BDBM3193 ...
MW:     466.436780 g/mol MF: C25H22O9
IUPAC name: 2-[2,6-dihydroxy-4-[4-(4-hydroxyphenyl)butan-2-yloxycarbonyl...
Create Date: 2006-01-30
CID: 5327953

563. 2-[[2,6-Dihydroxy-4-[[[3-(4-hydroxyphenyl)propyl]oxy]carbonyl]phenyl]carbonyl]-3-hydroxybenzoic Acid; Acyclic Balanol Analog 20b; AC1NS3FN ...
MW:     452.410200 g/mol MF: C24H20O9
IUPAC name: 2-[2,6-dihydroxy-4-[3-(4-hydroxyphenyl)propoxycarbonyl]benzo...
Create Date: 2006-01-30
CID: 5327952

564. Acyclic Balanol Analog 15b; AC1NS3FK; BDBM3191 ...
MW:     495.478000 g/mol MF: C26H25NO9
IUPAC name: 2-[4-[2-(dimethylamino)-3-(4-hydroxyphenyl)propoxy]carbonyl-...
Create Date: 2006-01-30
CID: 5327951

565. (+-)-2-[[2,6-Dihydroxy-4-[[[3-(4-hydroxyphenyl)-2-[(naphthylsulfonyl)amino]propyl]oxy]carbonyl]phenyl]carbonyl]-3-hydroxybenzoic Acid; Acyclic Balanol Analog 16b; AC1LD939 ...
MW:     657.643280 g/mol MF: C34H27NO11S
IUPAC name: 2-[2,6-dihydroxy-4-[3-(4-hydroxyphenyl)-2-(naphthalen-2-ylsu...
Create Date: 2005-06-01
CID: 644364

566. Fentanyl, meta-tolyl analog; AC1LDM4I; MEXMWWZFTYDPKV-UHFFFAOYSA-N ...
MW:     350.497100 g/mol MF: C23H30N2O
IUPAC name: N-(3-methylphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propan...
Create Date: 2005-03-27
CID: 621151

567. CAMPOTHECIN ANALOG; CPT-gly; AC1LADRL ...
MW:     405.403360 g/mol MF: C22H19N3O5
Create Date: 2005-08-01
CID: 486151

568. Thiazoloisoindol-5-one Ph analog; AC1L9SCI; BDBM1356 ...
MW:     267.345520 g/mol MF: C16H13NOS
IUPAC name: (9bS)-9b-phenyl-2,3-dihydro-[1,3]thiazolo[2,3-a]isoindol-5-o...
Create Date: 2005-08-01
CID: 455185

569. Thiazoloisoindol-5-one Ph analog; AC1L9SCF; CHEMBL85850 ...
MW:     267.345520 g/mol MF: C16H13NOS
IUPAC name: (9bR)-9b-phenyl-2,3-dihydro-[1,3]thiazolo[2,3-a]isoindol-5-o...
Create Date: 2005-08-01
CID: 455184

570. Thiocolchicoside; Musco-ril; 10-Thiocolchicoside ...
MW:     563.616620 g/mol MF: C27H33NO10S
IUPAC name: N-[1,2-dimethoxy-10-methylsulfanyl-9-oxo-3-[(2S,3R,4S,5S,6R)...
Create Date: 2005-08-01
CID: 72067

571. Urea analogue; BDBM50071948
MW:     446.541400 g/mol MF: C26H30N4O3+2
IUPAC name: [amino-[7-[2-[4-[1-(1-aminoethylidene)pyrrolidin-1-ium-3-yl]...
Create Date: 2014-10-13
CID: 78405027

572. 1400742-13-3; N-(Adamantan-1-yl)-1-(5-fluoropentyl)-1H-indazole-3-carboxamide; UNII-TX64ZY5P0R ...
MW:     383.502203 g/mol MF: C23H30FN3O
IUPAC name: N-(1-adamantyl)-1-(5-fluoropentyl)indazole-3-carboxamide
Create Date: 2013-09-21
CID: 71711119

573. NSC618381; Vinca analog; NSC-618381 ...
MW:     952.227980 g/mol MF: C55H77N5O9
Create Date: 2006-12-27
CID: 11969739

574. Isatin analog; NSC728563; NSC-728563 ...
MW:     531.606120 g/mol MF: C28H33N7O4
IUPAC name: (3Z)-3-[4-amino-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-...
Create Date: 2006-10-27
CID: 11820724

575. Thiazolidinedione analogue 28; 2-[(5Z)-5-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetic acid; 2-[(5Z)-5-{[5-(3,4-dichlorophenyl)furan-2-yl]methylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]acetic acid ...
MW:     398.217360 g/mol MF: C16H9Cl2NO5S
IUPAC name: 2-[(5Z)-5-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-2,...
Create Date: 2006-05-10
CID: 6539650

576. Creatinine-furan analogue 19; AC1O6ZYG; BDBM8454 ...
MW:     369.725650 g/mol MF: C16H11ClF3N3O2
IUPAC name: (5E)-2-amino-5-[[5-[2-chloro-5-(trifluoromethyl)phenyl]furan...
Create Date: 2006-05-10
CID: 6539644

577. Creatinine-furan analogue 18; AC1O6ZYE; BDBM8453 ...
MW:     301.727680 g/mol MF: C15H12ClN3O2
IUPAC name: (5E)-2-amino-5-[[5-(4-chlorophenyl)furan-2-yl]methylidene]-1...
Create Date: 2006-05-10
CID: 6539643

578. Thiazolidinedione analogue 17; 2-[(5Z)-5-({5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]acetic acid; 2-[(5Z)-5-[[5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetic acid ...
MW:     431.770270 g/mol MF: C17H9ClF3NO5S
IUPAC name: 2-[(5Z)-5-[[5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl...
Create Date: 2006-05-10
CID: 6539642

579. Rhodanine-furan analogue 10; AC1O6ZXU; BDBM8423 ...
MW:     456.921920 g/mol MF: C21H13ClN2O4S2
IUPAC name: 2-chloro-4-[5-[(Z)-[4-oxo-3-(pyridin-3-ylmethyl)-2-sulfanyli...
Create Date: 2006-05-10
CID: 6539633

580. N-[3-fluoro-5-(trifluoromethyl)phenyl]-4-(pyridin-4-ylmethyl)phthalazin-1-amine; CGP79787 Analog 66; AC1O4W7I ...
MW:     398.356273 g/mol MF: C21H14F4N4
IUPAC name: N-[3-fluoro-5-(trifluoromethyl)phenyl]-4-(pyridin-4-ylmethyl...
Create Date: 2006-01-30
CID: 6419397

581. N-[3-bromo-5-(trifluoromethyl)phenyl]-4-(pyridin-4-ylmethyl)phthalazin-1-amine; CGP79787 Analog 65; AC1O4W7H ...
MW:     459.261870 g/mol MF: C21H14BrF3N4
IUPAC name: N-[3-bromo-5-(trifluoromethyl)phenyl]-4-(pyridin-4-ylmethyl)...
Create Date: 2006-01-30
CID: 6419396

582. CHEMBL77555; N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(pyridin-4-ylmethyl)phthalazin-1-amine; CGP79787 Analog 64 ...
MW:     414.810870 g/mol MF: C21H14ClF3N4
IUPAC name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(pyridin-4-ylmethyl...
Create Date: 2006-01-30
CID: 6419395

583. N-(3,5-dimethylphenyl)-4-(pyridin-4-ylmethyl)phthalazin-1-amine; CGP79787 Analog 63; AC1O4W7F ...
MW:     340.421000 g/mol MF: C22H20N4
IUPAC name: N-(3,5-dimethylphenyl)-4-(pyridin-4-ylmethyl)phthalazin-1-am...
Create Date: 2006-01-30
CID: 6419394

584. CHEMBL75034; N-(4-chloro-3-methoxyphenyl)-4-(pyridin-4-ylmethyl)phthalazin-1-amine; CGP79787 Analog 62 ...
MW:     376.838880 g/mol MF: C21H17ClN4O
IUPAC name: N-(4-chloro-3-methoxyphenyl)-4-(pyridin-4-ylmethyl)phthalazi...
Create Date: 2006-01-30
CID: 6419393

585. N-(3,4-dichlorophenyl)-4-(pyridin-4-ylmethyl)phthalazin-1-amine; CGP79787 Analog 61; AC1O4W7D ...
MW:     381.257960 g/mol MF: C20H14Cl2N4
IUPAC name: N-(3,4-dichlorophenyl)-4-(pyridin-4-ylmethyl)phthalazin-1-am...
Create Date: 2006-01-30
CID: 6419392

586. 1-(3-Hydroxyanilino)-4-(4-pyridylmethyl)phthalazine; 3-[[4-(pyridin-4-ylmethyl)phthalazin-1-yl]amino]phenol; 3-{[4-(pyridin-4-ylmethyl)phthalazin-1-yl]amino}phenol ...
MW:     328.367240 g/mol MF: C20H16N4O
IUPAC name: 3-[[4-(pyridin-4-ylmethyl)phthalazin-1-yl]amino]phenol
Create Date: 2006-01-30
CID: 6419391

587. N-(3-methoxyphenyl)-4-(pyridin-4-ylmethyl)phthalazin-1-amine; CGP79787 Analog 59; AC1O4W7B ...
MW:     342.393820 g/mol MF: C21H18N4O
IUPAC name: N-(3-methoxyphenyl)-4-(pyridin-4-ylmethyl)phthalazin-1-amine
Create Date: 2006-01-30
CID: 6419390

588. N-(4-phenylphenyl)-4-(pyridin-4-ylmethyl)phthalazin-1-amine; CGP79787 Analog 58; AC1O4W7A ...
MW:     388.463800 g/mol MF: C26H20N4
IUPAC name: N-(4-phenylphenyl)-4-(pyridin-4-ylmethyl)phthalazin-1-amine
Create Date: 2006-01-30
CID: 6419389

589. CGP79787 Analog 57; AC1O4W79; BDBM4872 ...
MW:     368.474160 g/mol MF: C24H24N4
IUPAC name: N-(4-tert-butylphenyl)-4-(pyridin-4-ylmethyl)phthalazin-1-am...
Create Date: 2006-01-30
CID: 6419388

590. 1-(3-Methylanilino)-4-(4-pyridylmethyl)phthalazine; N-(3-methylphenyl)-4-(pyridin-4-ylmethyl)phthalazin-1-amine; CGP79787 Analog 56 ...
MW:     326.394420 g/mol MF: C21H18N4
IUPAC name: N-(3-methylphenyl)-4-(pyridin-4-ylmethyl)phthalazin-1-amine
Create Date: 2006-01-30
CID: 6419387

591. N-phenyl-4-(pyridin-4-ylmethyl)phthalazin-1-amine; CGP79787 Analog 55; CHEMBL74587 ...
MW:     312.367840 g/mol MF: C20H16N4
IUPAC name: N-phenyl-4-(pyridin-4-ylmethyl)phthalazin-1-amine
Create Date: 2006-01-30
CID: 6419386

592. CHEMBL306707; N-(4-chlorophenyl)-4,5-dimethyl-6-(pyridin-4-ylmethyl)pyridazin-3-amine; CGP79787 Analog 54 ...
MW:     324.807380 g/mol MF: C18H17ClN4
IUPAC name: N-(4-chlorophenyl)-4,5-dimethyl-6-(pyridin-4-ylmethyl)pyrida...
Create Date: 2006-01-30
CID: 6419385

593. N-(4-chlorophenyl)-4-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydrophthalazin-1-amine; CGP79787 Analog 53; CHEMBL75076 ...
MW:     350.844660 g/mol MF: C20H19ClN4
IUPAC name: N-(4-chlorophenyl)-4-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydro...
Create Date: 2006-01-30
CID: 6419384

594. CHEMBL75077; N-(4-chlorophenyl)-8-(pyridin-4-ylmethyl)pyrido[2,3-d]pyridazin-5-amine; CGP79787 Analog 50 ...
MW:     347.800960 g/mol MF: C19H14ClN5
IUPAC name: N-(4-chlorophenyl)-8-(pyridin-4-ylmethyl)pyrido[2,3-d]pyrida...
Create Date: 2006-01-30
CID: 6419383

595. N-(4-chlorophenyl)-4-(pyridin-4-ylmethyl)pyrido[3,4-d]pyridazin-1-amine; CGP79787 Analog 49; CHEMBL74550 ...
MW:     347.800960 g/mol MF: C19H14ClN5
IUPAC name: N-(4-chlorophenyl)-4-(pyridin-4-ylmethyl)pyrido[3,4-d]pyrida...
Create Date: 2006-01-30
CID: 6419382

596. CHEMBL433321; N-(4-chlorophenyl)-1-(pyridin-4-ylmethyl)pyrido[3,4-d]pyridazin-4-amine; CGP79787 Analog 48 ...
MW:     347.800960 g/mol MF: C19H14ClN5
IUPAC name: N-(4-chlorophenyl)-1-(pyridin-4-ylmethyl)pyrido[3,4-d]pyrida...
Create Date: 2006-01-30
CID: 6419381

597. CHEMBL306284; N-(4-chlorophenyl)-5-(pyridin-4-ylmethyl)pyrido[2,3-d]pyridazin-8-amine; CGP79787 Analog 47 ...
MW:     347.800960 g/mol MF: C19H14ClN5
IUPAC name: N-(4-chlorophenyl)-5-(pyridin-4-ylmethyl)pyrido[2,3-d]pyrida...
Create Date: 2006-01-30
CID: 6419380

598. N-(4-chlorophenyl)-7-methyl-4-(pyridin-4-ylmethyl)phthalazin-1-amine; CGP79787 Analog 46; AC1O4W70 ...
MW:     360.839480 g/mol MF: C21H17ClN4
IUPAC name: N-(4-chlorophenyl)-7-methyl-4-(pyridin-4-ylmethyl)phthalazin...
Create Date: 2006-01-30
CID: 6419379

599. CHEMBL74143; 1-N-(4-chlorophenyl)-4-(pyridin-4-ylmethyl)phthalazine-1,7-diamine; CGP79787 Analog 45 ...
MW:     361.827540 g/mol MF: C20H16ClN5
IUPAC name: 1-N-(4-chlorophenyl)-4-(pyridin-4-ylmethyl)phthalazine-1,7-d...
Create Date: 2006-01-30
CID: 6419378

600. CGP79787 Analog 52; AC1O3EEX; CHEMBL78160 ...
MW:     360.839480 g/mol MF: C21H17ClN4
IUPAC name: N-(4-chlorophenyl)-4-(1-pyridin-4-ylethyl)phthalazin-1-amine
Create Date: 2006-01-30
CID: 6326422

601. 1-(4-Chloroanilino)-4-(4-pyridylmethylamino)phthalazine; 1-N-(4-chlorophenyl)-4-N-(pyridin-4-ylmethyl)phthalazine-1,4-diamine; CGP79787 Analog 51 ...
MW:     361.827540 g/mol MF: C20H16ClN5
IUPAC name: 1-N-(4-chlorophenyl)-4-N-(pyridin-4-ylmethyl)phthalazine-1,4...
Create Date: 2006-01-30
CID: 6326421

602. N-(4-chlorophenyl)-4-[(2,6-dimethylpyridin-4-yl)methyl]phthalazin-1-amine; CGP79787 Analog 44; AC1O3EER ...
MW:     374.866060 g/mol MF: C22H19ClN4
IUPAC name: N-(4-chlorophenyl)-4-[(2,6-dimethylpyridin-4-yl)methyl]phtha...
Create Date: 2006-01-30
CID: 6326420

603. N-(4-chlorophenyl)-4-[(2-methylpyridin-4-yl)methyl]phthalazin-1-amine; CGP79787 Analog 43; AC1O3EEO ...
MW:     360.839480 g/mol MF: C21H17ClN4
IUPAC name: N-(4-chlorophenyl)-4-[(2-methylpyridin-4-yl)methyl]phthalazi...
Create Date: 2006-01-30
CID: 6326419

604. N-(4-chlorophenyl)-4-(pyrimidin-4-ylmethyl)phthalazin-1-amine; CGP79787 Analog 42; AC1O3EEL ...
MW:     347.800960 g/mol MF: C19H14ClN5
IUPAC name: N-(4-chlorophenyl)-4-(pyrimidin-4-ylmethyl)phthalazin-1-amin...
Create Date: 2006-01-30
CID: 6326418

605. N-(4-chlorophenyl)-4-(pyridin-2-ylmethyl)phthalazin-1-amine; CGP79787 Analog 41; AC1O3EEI ...
MW:     346.812900 g/mol MF: C20H15ClN4
IUPAC name: N-(4-chlorophenyl)-4-(pyridin-2-ylmethyl)phthalazin-1-amine
Create Date: 2006-01-30
CID: 6326417

606. N-(4-chlorophenyl)-4-(pyridin-3-ylmethyl)phthalazin-1-amine; CGP79787 Analog 40; AC1O3EEF ...
MW:     346.812900 g/mol MF: C20H15ClN4
IUPAC name: N-(4-chlorophenyl)-4-(pyridin-3-ylmethyl)phthalazin-1-amine
Create Date: 2006-01-30
CID: 6326416

607. CGP79787 Analog 39; AC1O3EEC; CHEMBL74391 ...
MW:     363.863260 g/mol MF: C20H14ClN3S
IUPAC name: 1-(4-chlorophenyl)sulfanyl-4-(pyridin-4-ylmethyl)phthalazine
Create Date: 2006-01-30
CID: 6326415

608. 1-(4-chlorophenoxy)-4-(pyridin-4-ylmethyl)phthalazine; CGP79787 Analog 38; AC1O3EE9 ...
MW:     347.797660 g/mol MF: C20H14ClN3O
IUPAC name: 1-(4-chlorophenoxy)-4-(pyridin-4-ylmethyl)phthalazine
Create Date: 2006-01-30
CID: 6326414

609. N-(4-chlorophenyl)-N-methyl-4-(pyridin-4-ylmethyl)phthalazin-1-amine; CGP79787 Analog 37; AC1O3EE6 ...
MW:     360.839480 g/mol MF: C21H17ClN4
IUPAC name: N-(4-chlorophenyl)-N-methyl-4-(pyridin-4-ylmethyl)phthalazin...
Create Date: 2006-01-30
CID: 6326413

610. NSC608832; Taxol analog
MW:    1088.629200 g/mol MF: C57H70ClN3O16
Create Date: 2006-02-27
CID: 5459063

611. SQ-67563 Analog 5; AC1NS7MZ; BDBM5796 ...
MW:     337.415520 g/mol MF: C20H23N3O2
IUPAC name: [1-ethyl-4-(3-methylbutoxy)pyrazolo[3,4-b]pyridin-5-yl]-phen...
Create Date: 2006-01-30
CID: 5329795

612. CHEMBL50371; PD089828 analog 31; AC1NS652 ...
MW:     422.526600 g/mol MF: C22H30N8O
IUPAC name: 1-[2-amino-6-[3,5-bis(dimethylamino)phenyl]pyrido[2,3-d]pyri...
Create Date: 2006-01-30
CID: 5329133

613. CHEMBL48809; PD089828 analog 30; AC1NS64Z ...
MW:     424.496120 g/mol MF: C22H28N6O3
IUPAC name: 1-[2-amino-6-(3,5-diethoxyphenyl)pyrido[2,3-d]pyrimidin-7-yl...
Create Date: 2006-01-30
CID: 5329132

614. PD089828 analog 29; AC1NS64W; CHEMBL78485 ...
MW:     380.443560 g/mol MF: C20H24N6O2
IUPAC name: 1-[2-amino-6-(3-ethoxyphenyl)pyrido[2,3-d]pyrimidin-7-yl]-3-...
Create Date: 2006-01-30
CID: 5329131

615. PD089828 analog 27; AC1NS64T; CHEMBL78802 ...
MW:     396.442960 g/mol MF: C20H24N6O3
IUPAC name: 1-[2-amino-6-(3,4-dimethoxyphenyl)pyrido[2,3-d]pyrimidin-7-y...
Create Date: 2006-01-30
CID: 5329130

616. PD089828 analog 26; AC1NS64Q; BDBM4845 ...
MW:     366.416980 g/mol MF: C19H22N6O2
IUPAC name: 1-[2-amino-6-(4-methoxyphenyl)pyrido[2,3-d]pyrimidin-7-yl]-3...
Create Date: 2006-01-30
CID: 5329129

617. PD089828 analog 25; AC1NS64N; CHEMBL81146 ...
MW:     366.416980 g/mol MF: C19H22N6O2
IUPAC name: 1-[2-amino-6-(3-methoxyphenyl)pyrido[2,3-d]pyrimidin-7-yl]-3...
Create Date: 2006-01-30
CID: 5329128

618. PD089828 analog 24; AC1NS64K; CHEMBL79241 ...
MW:     366.416980 g/mol MF: C19H22N6O2
IUPAC name: 1-[2-amino-6-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-7-yl]-3...
Create Date: 2006-01-30
CID: 5329127

619. PD089828 analog 23; AC1NS64H; BDBM4842 ...
MW:     392.497320 g/mol MF: C22H28N6O
IUPAC name: 1-[2-amino-6-(3,5-diethylphenyl)pyrido[2,3-d]pyrimidin-7-yl]...
Create Date: 2006-01-30
CID: 5329126

620. PD089828 analog 22; AC1NS64E; BDBM4841 ...
MW:     364.444160 g/mol MF: C20H24N6O
IUPAC name: 1-[2-amino-6-(2-ethylphenyl)pyrido[2,3-d]pyrimidin-7-yl]-3-t...
Create Date: 2006-01-30
CID: 5329125

621. PD089828 analog 21; AC1NS64B; BDBM4840 ...
MW:     479.617680 g/mol MF: C26H37N7O2
IUPAC name: 1-[2-amino-6-[3-[2-(diethylamino)ethoxy]-2,6-dimethylphenyl]...
Create Date: 2006-01-30
CID: 5329124

622. PD089828 analog 20; CHEMBL78555; AC1NS648 ...
MW:     406.523900 g/mol MF: C23H30N6O
IUPAC name: 1-[2-amino-6-(2,3,4,5,6-pentamethylphenyl)pyrido[2,3-d]pyrim...
Create Date: 2006-01-30
CID: 5329123

623. PD089828 analog 18; CHEMBL81615; AC1NS645 ...
MW:     378.470740 g/mol MF: C21H26N6O
IUPAC name: 1-[2-amino-6-(2,4,6-trimethylphenyl)pyrido[2,3-d]pyrimidin-7...
Create Date: 2006-01-30
CID: 5329122

624. PD089828 analog 17; CHEMBL81474; AC1NS642 ...
MW:     364.444160 g/mol MF: C20H24N6O
IUPAC name: 1-[2-amino-6-(3,5-dimethylphenyl)pyrido[2,3-d]pyrimidin-7-yl...
Create Date: 2006-01-30
CID: 5329121

625. PD089828 analog 16; AC1NS63Z; CHEMBL82431 ...
MW:     364.444160 g/mol MF: C20H24N6O
IUPAC name: 1-[2-amino-6-(2,3-dimethylphenyl)pyrido[2,3-d]pyrimidin-7-yl...
Create Date: 2006-01-30
CID: 5329120

626. PD089828 analog 14; AC1NS63W; BDBM4833 ...
MW:     350.417580 g/mol MF: C19H22N6O
IUPAC name: 1-[2-amino-6-(4-methylphenyl)pyrido[2,3-d]pyrimidin-7-yl]-3-...
Create Date: 2006-01-30
CID: 5329119

627. PD089828 analog 13; AC1NS63U; CHEMBL78393 ...
MW:     350.417580 g/mol MF: C19H22N6O
IUPAC name: 1-[2-amino-6-(2-methylphenyl)pyrido[2,3-d]pyrimidin-7-yl]-3-...
Create Date: 2006-01-30
CID: 5329118

628. CHEMBL49658; PD089828 analog 12; AC1NS63S ...
MW:     472.386939 g/mol MF: C20H18F6N6O
IUPAC name: 1-[2-amino-6-[3,5-bis(trifluoromethyl)phenyl]pyrido[2,3-d]py...
Create Date: 2006-01-30
CID: 5329117

629. PD089828 analog 11; AC1NS63P; CHEMBL81975 ...
MW:     372.371926 g/mol MF: C18H18F2N6O
IUPAC name: 1-[2-amino-6-(3,5-difluorophenyl)pyrido[2,3-d]pyrimidin-7-yl...
Create Date: 2006-01-30
CID: 5329116

630. PD089828 analog 10; AC1NS63M; CHEMBL77781 ...
MW:     372.371926 g/mol MF: C18H18F2N6O
IUPAC name: 1-[2-amino-6-(2,6-difluorophenyl)pyrido[2,3-d]pyrimidin-7-yl...
Create Date: 2006-01-30
CID: 5329115

631. PD158780 Analog 9u; AC1NS4F0; BDBM3731 ...
MW:     345.401060 g/mol MF: C19H19N7
IUPAC name: 6-N-[2-(1H-imidazol-5-yl)ethyl]-4-N-(3-methylphenyl)pyrido[3...
Create Date: 2006-01-30
CID: 5328380

632. PD158780 Analog 9o; AC1NS4EX; BDBM3730 ...
MW:     378.470740 g/mol MF: C21H26N6O
IUPAC name: 4-N-(3-methylphenyl)-6-N-(3-morpholin-4-ylpropyl)pyrido[3,4-...
Create Date: 2006-01-30
CID: 5328379

633. PD158780 Analog 9n; AC1NS4EU; BDBM3729 ...
MW:     364.444160 g/mol MF: C20H24N6O
IUPAC name: 4-N-(3-methylphenyl)-6-N-(2-morpholin-4-ylethyl)pyrido[3,4-d...
Create Date: 2006-01-30
CID: 5328378

634. 6-N,6-N-dimethyl-4-N-(3-methylphenyl)pyrido[3,4-d]pyrimidine-4,6-diamine; PD158780 Analog 9c; AC1NS4ER ...
MW:     279.339680 g/mol MF: C16H17N5
IUPAC name: 6-N,6-N-dimethyl-4-N-(3-methylphenyl)pyrido[3,4-d]pyrimidine...
Create Date: 2006-01-30
CID: 5328377

635. 6-N-methyl-4-N-(3-methylphenyl)pyrido[3,4-d]pyrimidine-4,6-diamine; PD158780 Analog 9b; AC1NS4EO ...
MW:     265.313100 g/mol MF: C15H15N5
IUPAC name: 6-N-methyl-4-N-(3-methylphenyl)pyrido[3,4-d]pyrimidine-4,6-d...
Create Date: 2006-01-30
CID: 5328376

636. 4-N-(3-methylphenyl)pyrido[3,4-d]pyrimidine-4,6-diamine; 6-amino-4-[(3-methylphenyl)amino]pyrido[3,4-d]pyrimidine; PD158780 Analog 9a ...
MW:     251.286520 g/mol MF: C14H13N5
IUPAC name: 4-N-(3-methylphenyl)pyrido[3,4-d]pyrimidine-4,6-diamine
Create Date: 2006-01-30
CID: 5328375

637. 6-N-methyl-4-N-[3-(trifluoromethyl)phenyl]pyrido[3,4-d]pyrimidine-4,6-diamine; PD158780 Analog 8b; AC1NS4EI ...
MW:     319.284490 g/mol MF: C15H12F3N5
IUPAC name: 6-N-methyl-4-N-[3-(trifluoromethyl)phenyl]pyrido[3,4-d]pyrim...
Create Date: 2006-01-30
CID: 5328374

638. 4-N-(3-chlorophenyl)-6-N-methylpyrido[3,4-d]pyrimidine-4,6-diamine; PD158780 Analog 7b; AC1NS4EF ...
MW:     285.731580 g/mol MF: C14H12ClN5
IUPAC name: 4-N-(3-chlorophenyl)-6-N-methylpyrido[3,4-d]pyrimidine-4,6-d...
Create Date: 2006-01-30
CID: 5328373

639. PD158780 Analog 5z; AC1NS4EC; BDBM3722 ...
MW:     388.218660 g/mol MF: C16H14BrN5O2
IUPAC name: 3-[[4-(3-bromoanilino)pyrido[3,4-d]pyrimidin-6-yl]amino]prop...
Create Date: 2006-01-30
CID: 5328372

640. PD158780 Analog 5y; AC1NS4E9; BDBM3721 ...
MW:     388.218660 g/mol MF: C16H14BrN5O2
IUPAC name: 2-[[4-(3-bromoanilino)pyrido[3,4-d]pyrimidin-6-yl]-methylami...
Create Date: 2006-01-30
CID: 5328371

641. PD158780 Analog 5x; AC1NS4E6; BDBM3720 ...
MW:     374.192080 g/mol MF: C15H12BrN5O2
IUPAC name: 2-[[4-(3-bromoanilino)pyrido[3,4-d]pyrimidin-6-yl]amino]acet...
Create Date: 2006-01-30
CID: 5328370

642. N-(3-bromophenyl)-6-(4-methylpiperazin-1-yl)pyrido[3,4-d]pyrimidin-4-amine; PD158780 Analog 5w; AC1NS4E3 ...
MW:     399.287660 g/mol MF: C18H19BrN6
IUPAC name: N-(3-bromophenyl)-6-(4-methylpiperazin-1-yl)pyrido[3,4-d]pyr...
Create Date: 2006-01-30
CID: 5328369

643. PD158780 Analog 5v; AC1NS4E0; BDBM3718 ...
MW:     424.297120 g/mol MF: C19H18BrN7
IUPAC name: 4-N-(3-bromophenyl)-6-N-(3-imidazol-1-ylpropyl)pyrido[3,4-d]...
Create Date: 2006-01-30
CID: 5328368

644. PD158780 Analog 5u; AC1NS4DX; BDBM3717 ...
MW:     410.270540 g/mol MF: C18H16BrN7
IUPAC name: 4-N-(3-bromophenyl)-6-N-[2-(1H-imidazol-5-yl)ethyl]pyrido[3,...
Create Date: 2006-01-30
CID: 5328367

645. PD158780 Analog 5t; AC1NS4DU; BDBM3716 ...
MW:     421.293180 g/mol MF: C20H17BrN6
IUPAC name: 4-N-(3-bromophenyl)-6-N-(2-pyridin-2-ylethyl)pyrido[3,4-d]py...
Create Date: 2006-01-30
CID: 5328366

646. 4-N-(3-bromophenyl)-6-N-(pyridin-3-ylmethyl)pyrido[3,4-d]pyrimidine-4,6-diamine; PD158780 Analog 5s; AC1NS4DR ...
MW:     407.266600 g/mol MF: C19H15BrN6
IUPAC name: 4-N-(3-bromophenyl)-6-N-(pyridin-3-ylmethyl)pyrido[3,4-d]pyr...
Create Date: 2006-01-30
CID: 5328365

647. PD158780 Analog 5r; AC1NS4DO; BDBM3714 ...
MW:     461.355500 g/mol MF: C20H25BrN6O2
IUPAC name: 2-[3-[[4-(3-bromoanilino)pyrido[3,4-d]pyrimidin-6-yl]amino]p...
Create Date: 2006-01-30
CID: 5328364

648. PD158780 Analog 5q; AC1NS4DL; BDBM3713 ...
MW:     447.328920 g/mol MF: C19H23BrN6O2
IUPAC name: 2-[2-[[4-(3-bromoanilino)pyrido[3,4-d]pyrimidin-6-yl]amino]e...
Create Date: 2006-01-30
CID: 5328363

649. 4-N-(3-bromophenyl)-6-N-[3-(4-methylpiperazin-1-yl)propyl]pyrido[3,4-d]pyrimidine-4,6-diamine; PD158780 Analog 5p; AC1NS4DI ...
MW:     456.382040 g/mol MF: C21H26BrN7
IUPAC name: 4-N-(3-bromophenyl)-6-N-[3-(4-methylpiperazin-1-yl)propyl]py...
Create Date: 2006-01-30
CID: 5328362

650. PD158780 Analog 5o; AC1NS4DF; BDBM3711 ...
MW:     443.340220 g/mol MF: C20H23BrN6O
IUPAC name: 4-N-(3-bromophenyl)-6-N-(3-morpholin-4-ylpropyl)pyrido[3,4-d...
Create Date: 2006-01-30
CID: 5328361

651. PD158780 Analog 5n; AC1NS4DC; BDBM3710 ...
MW:     429.313640 g/mol MF: C19H21BrN6O
IUPAC name: 4-N-(3-bromophenyl)-6-N-(2-morpholin-4-ylethyl)pyrido[3,4-d]...
Create Date: 2006-01-30
CID: 5328360

652. PD158780 Analog 5m; AC1NS4D9; BDBM3709 ...
MW:     401.303540 g/mol MF: C18H21BrN6
IUPAC name: 4-N-(3-bromophenyl)-6-N-[2-(dimethylamino)ethyl]-6-N-methylp...
Create Date: 2006-01-30
CID: 5328359

653. PD158780 Analog 5l; AC1NS4D6; BDBM3708 ...
MW:     417.302940 g/mol MF: C18H21BrN6O
IUPAC name: 2-[2-[[4-(3-bromoanilino)pyrido[3,4-d]pyrimidin-6-yl]amino]e...
Create Date: 2006-01-30
CID: 5328358

654. PD158780 Analog 5k; AC1NS4D3; BDBM3707 ...
MW:     445.356100 g/mol MF: C20H25BrN6O
IUPAC name: 1-[[4-(3-bromoanilino)pyrido[3,4-d]pyrimidin-6-yl]amino]-3-(...
Create Date: 2006-01-30
CID: 5328357

655. 4-N-(3-bromophenyl)-6-N-[4-(dimethylamino)butyl]pyrido[3,4-d]pyrimidine-4,6-diamine; PD158780 Analog 5j; AC1NS4D0 ...
MW:     415.330120 g/mol MF: C19H23BrN6
IUPAC name: 4-N-(3-bromophenyl)-6-N-[4-(dimethylamino)butyl]pyrido[3,4-d...
Create Date: 2006-01-30
CID: 5328356

656. 4-N-(3-bromophenyl)-6-N-[3-(dimethylamino)propyl]pyrido[3,4-d]pyrimidine-4,6-diamine; PD158780 Analog 5i; AC1NS4CX ...
MW:     401.303540 g/mol MF: C18H21BrN6
IUPAC name: 4-N-(3-bromophenyl)-6-N-[3-(dimethylamino)propyl]pyrido[3,4-...
Create Date: 2006-01-30
CID: 5328355

657. PD158780 Analog 5h; AC1NS4CU; BDBM3704 ...
MW:     387.276960 g/mol MF: C17H19BrN6
IUPAC name: 4-N-(3-bromophenyl)-6-N-[2-(dimethylamino)ethyl]pyrido[3,4-d...
Create Date: 2006-01-30
CID: 5328354

658. PD158780 Analog 5g; AC1NS4CR; BDBM3703 ...
MW:     404.261120 g/mol MF: C17H18BrN5O2
IUPAC name: 3-[[4-(3-bromoanilino)pyrido[3,4-d]pyrimidin-6-yl]-methylami...
Create Date: 2006-01-30
CID: 5328353

659. PD158780 Analog 5f; AC1NS4CO; BDBM3702 ...
MW:     390.234540 g/mol MF: C16H16BrN5O2
IUPAC name: 3-[[4-(3-bromoanilino)pyrido[3,4-d]pyrimidin-6-yl]amino]prop...
Create Date: 2006-01-30
CID: 5328352

660. PD158780 Analog 5e; AC1NS4CL; BDBM3701 ...
MW:     374.235140 g/mol MF: C16H16BrN5O
IUPAC name: 2-[[4-(3-bromoanilino)pyrido[3,4-d]pyrimidin-6-yl]-methylami...
Create Date: 2006-01-30
CID: 5328351

661. PD158780 Analog 5d; AC1NS4CI; BDBM3700 ...
MW:     360.208560 g/mol MF: C15H14BrN5O
IUPAC name: 2-[[4-(3-bromoanilino)pyrido[3,4-d]pyrimidin-6-yl]amino]etha...
Create Date: 2006-01-30
CID: 5328350

662. CHEMBL89940; 4-N-phenylquinazoline-4,6-diamine; PD153035 Analog 9 ...
MW:     236.271880 g/mol MF: C14H12N4
IUPAC name: 4-N-phenylquinazoline-4,6-diamine
Create Date: 2006-01-30
CID: 5328187

663. CHEMBL328879; 6-methoxy-N-phenylquinazolin-4-amine; PD153035 Analog 7 ...
MW:     251.283220 g/mol MF: C15H13N3O
IUPAC name: 6-methoxy-N-phenylquinazolin-4-amine
Create Date: 2006-01-30
CID: 5328186

664. 3-Pyridinealdehyde nad; 3-Pyridinealdehyde-NAD; 3-Pyridine aldehyde-DPN ...
MW:     648.410464 g/mol MF: C21H26N6O14P2
IUPAC name: [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-...
Create Date: 2005-08-08
CID: 3036913

665. STK153174; Rhodanine-furan analogue 20; AC1M466K ...
MW:     405.875180 g/mol MF: C18H12ClNO4S2
IUPAC name: 2-chloro-4-[5-[(Z)-(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-...
Create Date: 2005-07-15
CID: 2276735

666. Fentanyl propyl acetyl analog; AC1LDBVR; QZTILTHMQXTRFP-UHFFFAOYSA-N ...
MW:     336.470520 g/mol MF: C22H28N2O
IUPAC name: N-phenyl-N-[1-(3-phenylpropyl)piperidin-4-yl]acetamide
Create Date: 2005-03-27
CID: 615722

667. 2,7-bis(2-dimethylaminoethyloxy)xanthen-9-one; 2,7-Bis[2-(dimethylamino)ethoxy]xanthen-9-one; Xanthone analog ...
MW:     370.442140 g/mol MF: C21H26N2O4
IUPAC name: 2,7-bis[2-(dimethylamino)ethoxy]xanthen-9-one
Create Date: 2005-08-01
CID: 482203

668. 3,5,6-tri(2-pyridyl)-1,2,4-triazine; 1046-57-7; 3,5,6-tri(pyridin-2-yl)-1,2,4-triazine ...
MW:     312.328080 g/mol MF: C18H12N6
IUPAC name: 3,5,6-tripyridin-2-yl-1,2,4-triazine
Create Date: 2005-07-19
CID: 473557

669. Cytidine analog; AC1LAIIT; (4E)-5-(2-chloroethyl)-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4-hydroxyimino-pyrimidin-2-one ...
MW:     305.714840 g/mol MF: C11H16ClN3O5
IUPAC name: 5-(2-chloroethyl)-4-(hydroxyamino)-1-[(2R,4S,5R)-4-hydroxy-5...
Create Date: 2005-08-01
CID: 469095

670. 3-Pyridinealdehyde adenine dinucleotide; 3-Pyridinealdehyde-DPN; 3-Pyridinealdehyde-NAD ...
MW:     649.418404 g/mol MF: C21H27N6O14P2+
IUPAC name: [[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hyd...
Create Date: 2005-03-26
CID: 409335

671. UNII-120SQ2FIK4; 120SQ2FIK4; SCHEMBL16104238 ...
MW:     345.906120 g/mol MF: C21H28ClNO
IUPAC name: [1-(5-chloropentyl)indol-3-yl]-(2,2,3,3-tetramethylcycloprop...
Create Date: 2015-02-13
CID: 90464183

672. Tropane analogue; CHEMBL139425; BDBM50107327 ...
MW:     476.600566 g/mol MF: C30H34F2N2O
IUPAC name: 4-[4-[3-[bis(4-fluorophenyl)methoxy]-8-azabicyclo[3.2.1]octa...
Create Date: 2007-02-07
CID: 12066271

673. CHEMBL1165659; PM-20; 863886-38-8 ...
MW:     401.499160 g/mol MF: C20H19NO4S2
IUPAC name: 3,4-bis(2-hydroxyethylsulfanyl)-1-(4-phenylphenyl)pyrrole-2,...
Create Date: 2006-10-26
CID: 11200445

674. Rhodanine-thiazole analogue 27; 2-[(5Z)-5-[[5-(4-fluorophenyl)-1,3-thiazol-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid; 2-[(5Z)-5-{[5-(4-fluorophenyl)-1,3-thiazol-2-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid ...
MW:     380.436963 g/mol MF: C15H9FN2O3S3
IUPAC name: 2-[(5Z)-5-[[5-(4-fluorophenyl)-1,3-thiazol-2-yl]methylidene]...
Create Date: 2006-05-10
CID: 6539649

675. Rhodanine-thiazole analogue 16; 2-[(5Z)-5-[[5-(4-bromophenyl)-1,3-thiazol-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid; 2-[(5Z)-5-{[5-(4-bromophenyl)-1,3-thiazol-2-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid ...
MW:     441.342560 g/mol MF: C15H9BrN2O3S3
IUPAC name: 2-[(5Z)-5-[[5-(4-bromophenyl)-1,3-thiazol-2-yl]methylidene]-...
Create Date: 2006-05-10
CID: 6539641

676. Rhodanine-thiazole analogue 15; 2-[(5Z)-5-[[5-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid; 2-[(5Z)-5-{[5-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid ...
MW:     422.498460 g/mol MF: C17H14N2O5S3
IUPAC name: 2-[(5Z)-5-[[5-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]methyli...
Create Date: 2006-05-10
CID: 6539640

677. Rhodanine-thiazole analogue 14; 2-[(5Z)-5-[[5-(4-chlorophenyl)-1,3-thiazol-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid; 2-[(5Z)-5-{[5-(4-chlorophenyl)-1,3-thiazol-2-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid ...
MW:     396.891560 g/mol MF: C15H9ClN2O3S3
IUPAC name: 2-[(5Z)-5-[[5-(4-chlorophenyl)-1,3-thiazol-2-yl]methylidene]...
Create Date: 2006-05-10
CID: 6539639

678. 2-[(5Z)-4-oxo-2-sulfanylidene-5-(1,3-thiazol-2-ylmethylidene)-1,3-thiazolidin-3-yl]acetic acid; Rhodanine-thiazole analogue 13; AC1O6ZY4 ...
MW:     286.350540 g/mol MF: C9H6N2O3S3
IUPAC name: 2-[(5Z)-4-oxo-2-sulfanylidene-5-(1,3-thiazol-2-ylmethylidene...
Create Date: 2006-05-10
CID: 6539638

679. 2-[(5Z)-4-oxo-5-[(5-phenylthiophen-2-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid; Rhodanine-thiophene analogue 9; AC1O6ZXY ...
MW:     361.458440 g/mol MF: C16H11NO3S3
IUPAC name: 2-[(5Z)-4-oxo-5-[(5-phenylthiophen-2-yl)methylidene]-2-sulfa...
Create Date: 2006-05-10
CID: 6539635

680. SQ-67563 Analog 11j; AC1NS7NE; BDBM5801 ...
MW:     310.350420 g/mol MF: C17H18N4O2
IUPAC name: [4-[2-(dimethylamino)ethoxy]-1H-pyrazolo[3,4-b]pyridin-5-yl]...
Create Date: 2006-01-30
CID: 5329800

681. SQ-67563 Analog 11i; AC1NS7NB; CHEMBL14709 ...
MW:     283.282020 g/mol MF: C15H13N3O3
IUPAC name: [4-(2-hydroxyethoxy)-1H-pyrazolo[3,4-b]pyridin-5-yl]-phenylm...
Create Date: 2006-01-30
CID: 5329799

682. SQ-67563 Analog 11h; AC1NS7N8; BDBM5799 ...
MW:     315.325420 g/mol MF: C19H13N3O2
IUPAC name: (4-phenoxy-1H-pyrazolo[3,4-b]pyridin-5-yl)-phenylmethanone
Create Date: 2006-01-30
CID: 5329798

683. SQ-67563 Analog 11b; AC1NS7N5; CHEMBL14124 ...
MW:     308.377600 g/mol MF: C18H20N4O
IUPAC name: [4-[butyl(methyl)amino]-1H-pyrazolo[3,4-b]pyridin-5-yl]-phen...
Create Date: 2006-01-30
CID: 5329797

684. SQ-67563 Analog 11a; AC1NS7N2; BDBM5797 ...
MW:     311.401380 g/mol MF: C17H17N3OS
IUPAC name: (4-butylsulfanyl-1H-pyrazolo[3,4-b]pyridin-5-yl)-phenylmetha...
Create Date: 2006-01-30
CID: 5329796

685. SQ-67563 Analog 21l; AC1NS7MW; CHEMBL79937 ...
MW:     337.415520 g/mol MF: C20H23N3O2
IUPAC name: (4-butoxy-1H-pyrazolo[3,4-b]pyridin-5-yl)-(2,4,6-trimethylph...
Create Date: 2006-01-30
CID: 5329794

686. SQ-67563 Analog 21d; AC1NS7MT; CHEMBL77843 ...
MW:     309.362360 g/mol MF: C18H19N3O2
IUPAC name: (4-butoxy-1H-pyrazolo[3,4-b]pyridin-5-yl)-(4-methylphenyl)me...
Create Date: 2006-01-30
CID: 5329793

687. SQ-67563 Analog 21c; AC1NS7MQ; CHEMBL78427 ...
MW:     309.362360 g/mol MF: C18H19N3O2
IUPAC name: (4-butoxy-1H-pyrazolo[3,4-b]pyridin-5-yl)-(3-methylphenyl)me...
Create Date: 2006-01-30
CID: 5329792

688. 4-butoxy-N-methoxy-1H-pyrazolo[3,4-b]pyridine-5-carboxamide; SQ-67563 Analog 10j; AC1NS7MN ...
MW:     264.280440 g/mol MF: C12H16N4O3
IUPAC name: 4-butoxy-N-methoxy-1H-pyrazolo[3,4-b]pyridine-5-carboxamide
Create Date: 2006-01-30
CID: 5329791

689. 4-butoxy-N-ethyl-1H-pyrazolo[3,4-b]pyridine-5-carboxamide; SQ-67563 Analog 10i; AC1NS7MK ...
MW:     262.307620 g/mol MF: C13H18N4O2
IUPAC name: 4-butoxy-N-ethyl-1H-pyrazolo[3,4-b]pyridine-5-carboxamide
Create Date: 2006-01-30
CID: 5329790

690. 4-butoxy-N-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carboxamide; SQ-67563 Analog 10h; AC1NS7MH ...
MW:     310.350420 g/mol MF: C17H18N4O2
IUPAC name: 4-butoxy-N-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carboxamide
Create Date: 2006-01-30
CID: 5329789

691. SQ-67563 Analog 10d; AC1NS7ME; BDBM5789 ...
MW:     296.323840 g/mol MF: C16H16N4O2
IUPAC name: (4-butoxy-1H-pyrazolo[3,4-b]pyridin-5-yl)-pyridin-3-ylmethan...
Create Date: 2006-01-30
CID: 5329788

692. SQ-67563 Analog 10c; AC1NS7MB; BDBM5788 ...
MW:     309.362360 g/mol MF: C18H19N3O2
IUPAC name: 1-(4-butoxy-1H-pyrazolo[3,4-b]pyridin-5-yl)-2-phenylethanone
Create Date: 2006-01-30
CID: 5329787

693. SQ-67563 Analog 10b; AC1NS7M8; CHEMBL77726 ...
MW:     259.303680 g/mol MF: C14H17N3O2
IUPAC name: (4-butoxy-1H-pyrazolo[3,4-b]pyridin-5-yl)-cyclopropylmethano...
Create Date: 2006-01-30
CID: 5329786

694. SQ-67563 Analog 10a; AC1NS7M5; CHEMBL80750 ...
MW:     233.266400 g/mol MF: C12H15N3O2
IUPAC name: 1-(4-butoxy-1H-pyrazolo[3,4-b]pyridin-5-yl)ethanone
Create Date: 2006-01-30
CID: 5329785

695. SQ-67563 Analog 11g; AC1NS7LZ; CHEMBL14593 ...
MW:     329.352000 g/mol MF: C20H15N3O2
IUPAC name: phenyl-(4-phenylmethoxy-1H-pyrazolo[3,4-b]pyridin-5-yl)metha...
Create Date: 2006-01-30
CID: 5329783

696. SQ-67563 Analog 11f; AC1NS7LW; BDBM5783 ...
MW:     321.373060 g/mol MF: C19H19N3O2
IUPAC name: (4-cyclohexyloxy-1H-pyrazolo[3,4-b]pyridin-5-yl)-phenylmetha...
Create Date: 2006-01-30
CID: 5329782

697. SQ-67563 Analog 11e; AC1NS7LT; CHEMBL14327 ...
MW:     309.362360 g/mol MF: C18H19N3O2
IUPAC name: (4-pentan-2-yloxy-1H-pyrazolo[3,4-b]pyridin-5-yl)-phenylmeth...
Create Date: 2006-01-30
CID: 5329781

698. SQ-67563 Analog 11d; AC1NS7LQ; BDBM5781 ...
MW:     309.362360 g/mol MF: C18H19N3O2
IUPAC name: (4-pentoxy-1H-pyrazolo[3,4-b]pyridin-5-yl)-phenylmethanone
Create Date: 2006-01-30
CID: 5329780

699. SQ-67563 Analog 11c; AC1NS7LN; BDBM5780 ...
MW:     281.309200 g/mol MF: C16H15N3O2
IUPAC name: phenyl-(4-propoxy-1H-pyrazolo[3,4-b]pyridin-5-yl)methanone
Create Date: 2006-01-30
CID: 5329779

700. SQ-67563 Analog 21k; AC1NS7LK; BDBM5779 ...
MW:     361.342686 g/mol MF: C18H17F2N3O3
IUPAC name: (4-butoxy-1H-pyrazolo[3,4-b]pyridin-5-yl)-(2,6-difluoro-4-me...
Create Date: 2006-01-30
CID: 5329778

701. SQ-67563 Analog 21j; AC1NS7LH; BDBM5778 ...
MW:     410.212766 g/mol MF: C17H14BrF2N3O2
IUPAC name: (4-bromo-2,6-difluorophenyl)-(4-butoxy-1H-pyrazolo[3,4-b]pyr...
Create Date: 2006-01-30
CID: 5329777

702. SQ-67563 Analog 21i; AC1NS7LE; CHEMBL81211 ...
MW:     365.761766 g/mol MF: C17H14ClF2N3O2
IUPAC name: (4-butoxy-1H-pyrazolo[3,4-b]pyridin-5-yl)-(4-chloro-2,6-difl...
Create Date: 2006-01-30
CID: 5329776

703. SQ-67563 Analog 21g; AC1NS7L8; CHEMBL79049 ...
MW:     349.307170 g/mol MF: C17H14F3N3O2
IUPAC name: (4-butoxy-1H-pyrazolo[3,4-b]pyridin-5-yl)-(2,4,6-trifluoroph...
Create Date: 2006-01-30
CID: 5329774

704. SQ-67563 Analog 21f; AC1NS7L5; CHEMBL78200 ...
MW:     331.316706 g/mol MF: C17H15F2N3O2
IUPAC name: (4-butoxy-1H-pyrazolo[3,4-b]pyridin-5-yl)-(2,6-difluoropheny...
Create Date: 2006-01-30
CID: 5329773

705. SQ-67563 Analog 21e; AC1NS7L2; CHEMBL79452 ...
MW:     313.326243 g/mol MF: C17H16FN3O2
IUPAC name: (4-butoxy-1H-pyrazolo[3,4-b]pyridin-5-yl)-(2-fluorophenyl)me...
Create Date: 2006-01-30
CID: 5329772

706. SQ-67563 Analog 21b; AC1NS7KZ; CHEMBL81771 ...
MW:     309.362360 g/mol MF: C18H19N3O2
IUPAC name: (4-butoxy-1H-pyrazolo[3,4-b]pyridin-5-yl)-(2-methylphenyl)me...
Create Date: 2006-01-30
CID: 5329771

707. SQ-67563 Analog 10g; AC1NS7KW; CHEMBL78959 ...
MW:     302.351560 g/mol MF: C14H14N4O2S
IUPAC name: (4-butoxy-1H-pyrazolo[3,4-b]pyridin-5-yl)-(1,3-thiazol-2-yl)...
Create Date: 2006-01-30
CID: 5329770

708. SQ-67563 Analog 10f; AC1NS7KT; CHEMBL82243 ...
MW:     301.363500 g/mol MF: C15H15N3O2S
IUPAC name: (4-butoxy-1H-pyrazolo[3,4-b]pyridin-5-yl)-thiophen-2-ylmetha...
Create Date: 2006-01-30
CID: 5329769

709. SQ-67563 Analog 10e; AC1NS7KQ; BDBM5769 ...
MW:     285.297900 g/mol MF: C15H15N3O3
IUPAC name: (4-butoxy-1H-pyrazolo[3,4-b]pyridin-5-yl)-(furan-2-yl)methan...
Create Date: 2006-01-30
CID: 5329768

710. PD158780 Analog 10n; AC1NS4F3; BDBM3732 ...
MW:     443.340220 g/mol MF: C20H23BrN6O
IUPAC name: 4-N-(3-bromophenyl)-2-methyl-6-N-(2-morpholin-4-ylethyl)pyri...
Create Date: 2006-01-30
CID: 5328381

711. CHEMBL92709; N-(3,5-dibromophenyl)-6,7-dimethoxyquinazolin-4-amine; PD153035 Analog 69 ...
MW:     439.101320 g/mol MF: C16H13Br2N3O2
IUPAC name: N-(3,5-dibromophenyl)-6,7-dimethoxyquinazolin-4-amine
Create Date: 2006-01-30
CID: 5328232

712. CHEMBL327307; N-(3,4-dibromophenyl)-6,7-dimethoxyquinazolin-4-amine; PD153035 Analog 68 ...
MW:     439.101320 g/mol MF: C16H13Br2N3O2
IUPAC name: N-(3,4-dibromophenyl)-6,7-dimethoxyquinazolin-4-amine
Create Date: 2006-01-30
CID: 5328231

713. CHEMBL92174; N-(2-bromophenyl)-6,7-dimethoxyquinazolin-4-amine; PD153035 Analog 66 ...
MW:     360.205260 g/mol MF: C16H14BrN3O2
IUPAC name: N-(2-bromophenyl)-6,7-dimethoxyquinazolin-4-amine
Create Date: 2006-01-30
CID: 5328230

714. CHEMBL431811; N-(3-bromophenyl)-6,7,8-trimethoxyquinazolin-4-amine; PD153035 Analog 65 ...
MW:     390.231240 g/mol MF: C17H16BrN3O3
IUPAC name: N-(3-bromophenyl)-6,7,8-trimethoxyquinazolin-4-amine
Create Date: 2006-01-30
CID: 5328229

715. CHEMBL317925; N-(3-bromophenyl)-5,6,7-trimethoxyquinazolin-4-amine; PD153035 Analog 64 ...
MW:     390.231240 g/mol MF: C17H16BrN3O3
IUPAC name: N-(3-bromophenyl)-5,6,7-trimethoxyquinazolin-4-amine
Create Date: 2006-01-30
CID: 5328228

716. EBE-A22; CHEMBL447230; N-(3-bromophenyl)-6,7-dimethoxy-N-methylquinazolin-4-amine ...
MW:     374.231840 g/mol MF: C17H16BrN3O2
IUPAC name: N-(3-bromophenyl)-6,7-dimethoxy-N-methylquinazolin-4-amine
Create Date: 2006-01-30
CID: 5328227

717. CHEMBL93295; 4-N-(3-bromophenyl)-6,7-dimethoxyquinazoline-2,4-diamine; PD153035 Analog 62 ...
MW:     375.219900 g/mol MF: C16H15BrN4O2
IUPAC name: 4-N-(3-bromophenyl)-6,7-dimethoxyquinazoline-2,4-diamine
Create Date: 2006-01-30
CID: 5328226

718. CHEMBL294769; N-(3-bromophenyl)-6,7-dimethoxy-2-methylquinazolin-4-amine; PD153035 Analog 61 ...
MW:     374.231840 g/mol MF: C17H16BrN3O2
IUPAC name: N-(3-bromophenyl)-6,7-dimethoxy-2-methylquinazolin-4-amine
Create Date: 2006-01-30
CID: 5328225

719. CHEMBL93346; N-(3-bromophenyl)-7,8-dimethoxyquinazolin-4-amine; PD153035 Analog 60 ...
MW:     360.205260 g/mol MF: C16H14BrN3O2
IUPAC name: N-(3-bromophenyl)-7,8-dimethoxyquinazolin-4-amine
Create Date: 2006-01-30
CID: 5328224

720. CHEMBL96627; N-(3-bromophenyl)-5,6-dimethoxyquinazolin-4-amine; PD153035 Analog 59 ...
MW:     360.205260 g/mol MF: C16H14BrN3O2
IUPAC name: N-(3-bromophenyl)-5,6-dimethoxyquinazolin-4-amine
Create Date: 2006-01-30
CID: 5328223

721. CHEMBL318736; N-(3-bromophenyl)-6,7-dibutoxyquinazolin-4-amine; PD153035 Analog 58 ...
MW:     444.364740 g/mol MF: C22H26BrN3O2
IUPAC name: N-(3-bromophenyl)-6,7-dibutoxyquinazolin-4-amine
Create Date: 2006-01-30
CID: 5328222

722. CHEMBL418967; N-(3-bromophenyl)-6,7-dipropoxyquinazolin-4-amine; PD153035 Analog 57 ...
MW:     416.311580 g/mol MF: C20H22BrN3O2
IUPAC name: N-(3-bromophenyl)-6,7-dipropoxyquinazolin-4-amine
Create Date: 2006-01-30
CID: 5328221

723. CHEMBL93051; PD153035 Analog 54; AC1NS41P ...
MW:     344.162800 g/mol MF: C15H10BrN3O2
IUPAC name: N-(3-bromophenyl)-[1,3]dioxolo[4,5-g]quinazolin-8-amine
Create Date: 2006-01-30
CID: 5328220

724. CHEMBL66409; N-(3-bromophenyl)-7-chloro-6-nitroquinazolin-4-amine; PD153035 Analog 53 ...
MW:     379.595920 g/mol MF: C14H8BrClN4O2
IUPAC name: N-(3-bromophenyl)-7-chloro-6-nitroquinazolin-4-amine
Create Date: 2006-01-30
CID: 5328219

725. CHEMBL65038; N-(3-bromophenyl)-7-methoxy-6-nitroquinazolin-4-amine; PD153035 Analog 52 ...
MW:     375.176840 g/mol MF: C15H11BrN4O3
IUPAC name: N-(3-bromophenyl)-7-methoxy-6-nitroquinazolin-4-amine
Create Date: 2006-01-30
CID: 5328218

726. CHEMBL93734; 7-acetamido-4-(3-bromoanilino)-6-nitroquinazoline; 169205-91-8 ...
MW:     402.202180 g/mol MF: C16H12BrN5O3
IUPAC name: N-[4-(3-bromoanilino)-6-nitroquinazolin-7-yl]acetamide
Create Date: 2006-01-30
CID: 5328217

727. CHEMBL93544; 4-N-(3-bromophenyl)-7-N,7-N-dimethyl-6-nitroquinazoline-4,7-diamine; PD153035 Analog 50 ...
MW:     388.218660 g/mol MF: C16H14BrN5O2
IUPAC name: 4-N-(3-bromophenyl)-7-N,7-N-dimethyl-6-nitroquinazoline-4,7-...
Create Date: 2006-01-30
CID: 5328216

728. CHEMBL92936; 4-N-(3-bromophenyl)-7-N-methyl-6-nitroquinazoline-4,7-diamine; PD153035 Analog 49 ...
MW:     374.192080 g/mol MF: C15H12BrN5O2
IUPAC name: 4-N-(3-bromophenyl)-7-N-methyl-6-nitroquinazoline-4,7-diamin...
Create Date: 2006-01-30
CID: 5328215

729. CHEMBL93545; 4-N-(3-bromophenyl)-6-nitroquinazoline-4,7-diamine; PD153035 Analog 48 ...
MW:     360.165500 g/mol MF: C14H10BrN5O2
IUPAC name: 4-N-(3-bromophenyl)-6-nitroquinazoline-4,7-diamine
Create Date: 2006-01-30
CID: 5328214

730. CHEMBL63469; 4-N-(3-bromophenyl)-7-chloroquinazoline-4,6-diamine; PD153035 Analog 47 ...
MW:     349.613000 g/mol MF: C14H10BrClN4
IUPAC name: 4-N-(3-bromophenyl)-7-chloroquinazoline-4,6-diamine
Create Date: 2006-01-30
CID: 5328213

731. CHEMBL96780; 4-N-(3-bromophenyl)-7-methoxyquinazoline-4,6-diamine; PD153035 Analog 46 ...
MW:     345.193920 g/mol MF: C15H13BrN4O
IUPAC name: 4-N-(3-bromophenyl)-7-methoxyquinazoline-4,6-diamine
Create Date: 2006-01-30
CID: 5328212

732. CHEMBL96489; 4-N-(3-bromophenyl)-7-N,7-N-dimethylquinazoline-4,6,7-triamine; PD153035 Analog 45 ...
MW:     358.235740 g/mol MF: C16H16BrN5
IUPAC name: 4-N-(3-bromophenyl)-7-N,7-N-dimethylquinazoline-4,6,7-triami...
Create Date: 2006-01-30
CID: 5328211

733. CHEMBL90013; 4-N-(3-bromophenyl)-7-N,7-N-dimethylquinazoline-4,7-diamine; PD153035 Analog 42 ...
MW:     343.221100 g/mol MF: C16H15BrN4
IUPAC name: 4-N-(3-bromophenyl)-7-N,7-N-dimethylquinazoline-4,7-diamine
Create Date: 2006-01-30
CID: 5328210

734. CHEMBL420254; 4-N-(3-bromophenyl)-7-N-ethylquinazoline-4,7-diamine; PD153035 Analog 41 ...
MW:     343.221100 g/mol MF: C16H15BrN4
IUPAC name: 4-N-(3-bromophenyl)-7-N-ethylquinazoline-4,7-diamine
Create Date: 2006-01-30
CID: 5328209

735. CHEMBL92812; 4-N-(3-bromophenyl)-7-N-methylquinazoline-4,7-diamine; PD153035 Analog 40 ...
MW:     329.194520 g/mol MF: C15H13BrN4
IUPAC name: 4-N-(3-bromophenyl)-7-N-methylquinazoline-4,7-diamine
Create Date: 2006-01-30
CID: 5328208

736. CHEMBL93461; PD153035 Analog 39; AC1NS40M ...
MW:     357.204620 g/mol MF: C16H13BrN4O
IUPAC name: N-[4-(3-bromoanilino)quinazolin-7-yl]acetamide
Create Date: 2006-01-30
CID: 5328207

737. CHEMBL93302; PD153035 Analog 38; AC1NS40J ...
MW:     316.152700 g/mol MF: C14H10BrN3O
IUPAC name: 4-(3-bromoanilino)-1H-quinazolin-7-one
Create Date: 2006-01-30
CID: 5328206

738. CHEMBL328691; PD153035 Analog 37; AC1NS40G ...
MW:     373.204020 g/mol MF: C16H13BrN4O2
IUPAC name: methyl N-[4-(3-bromoanilino)quinazolin-6-yl]carbamate
Create Date: 2006-01-30
CID: 5328205

739. CHEMBL52015; 4-N-(3-bromophenyl)-6-N,6-N-dimethylquinazoline-4,6-diamine; PD153035 Analog 36 ...
MW:     343.221100 g/mol MF: C16H15BrN4
IUPAC name: 4-N-(3-bromophenyl)-6-N,6-N-dimethylquinazoline-4,6-diamine
Create Date: 2006-01-30
CID: 5328204

740. CHEMBL50344; 4-N-(3-bromophenyl)-6-N-methylquinazoline-4,6-diamine; PD153035 Analog 35 ...
MW:     329.194520 g/mol MF: C15H13BrN4
IUPAC name: 4-N-(3-bromophenyl)-6-N-methylquinazoline-4,6-diamine
Create Date: 2006-01-30
CID: 5328203

741. CHEMBL316064; 6,7-dimethoxy-N-[3-(trifluoromethyl)phenyl]quinazolin-4-amine; 6,7-dimethoxy-N-(3-(trifluoromethyl)phenyl)quinazolin-4-amine ...
MW:     349.307170 g/mol MF: C17H14F3N3O2
IUPAC name: 6,7-dimethoxy-N-[3-(trifluoromethyl)phenyl]quinazolin-4-amin...
Create Date: 2006-01-30
CID: 5328202

742. N-(3-iodophenyl)-6,7-dimethoxyquinazolin-4-amine; CHEMBL96065; 189290-58-2 ...
MW:     407.205730 g/mol MF: C16H14IN3O2
IUPAC name: N-(3-iodophenyl)-6,7-dimethoxyquinazolin-4-amine
Create Date: 2006-01-30
CID: 5328201

743. CHEMBL94432; 7-nitro-N-[3-(trifluoromethyl)phenyl]quinazolin-4-amine; PD153035 Analog 28 ...
MW:     334.252770 g/mol MF: C15H9F3N4O2
IUPAC name: 7-nitro-N-[3-(trifluoromethyl)phenyl]quinazolin-4-amine
Create Date: 2006-01-30
CID: 5328200

744. CHEMBL93284; N-(3-iodophenyl)-7-nitroquinazolin-4-amine; PD153035 Analog 27 ...
MW:     392.151330 g/mol MF: C14H9IN4O2
IUPAC name: N-(3-iodophenyl)-7-nitroquinazolin-4-amine
Create Date: 2006-01-30
CID: 5328199

745. CHEMBL93635; N-(3-chlorophenyl)-7-nitroquinazolin-4-amine; PD153035 Analog 25 ...
MW:     300.699860 g/mol MF: C14H9ClN4O2
IUPAC name: N-(3-chlorophenyl)-7-nitroquinazolin-4-amine
Create Date: 2006-01-30
CID: 5328198

746. CHEMBL329183; N-(3-fluorophenyl)-7-nitroquinazolin-4-amine; PD153035 Analog 24 ...
MW:     284.245263 g/mol MF: C14H9FN4O2
IUPAC name: N-(3-fluorophenyl)-7-nitroquinazolin-4-amine
Create Date: 2006-01-30
CID: 5328197

747. 4-Quinazolinamine, 7-nitro-N-phenyl-; CHEMBL91914; 7-nitro-N-phenylquinazolin-4-amine ...
MW:     266.254800 g/mol MF: C14H10N4O2
IUPAC name: 7-nitro-N-phenylquinazolin-4-amine
Create Date: 2006-01-30
CID: 5328196

748. CHEMBL433205; 4-N-[3-(trifluoromethyl)phenyl]quinazoline-4,7-diamine; PD153035 Analog 22 ...
MW:     304.269850 g/mol MF: C15H11F3N4
IUPAC name: 4-N-[3-(trifluoromethyl)phenyl]quinazoline-4,7-diamine
Create Date: 2006-01-30
CID: 5328195

749. CHEMBL91980; 4-N-(3-iodophenyl)quinazoline-4,7-diamine; PD153035 Analog 21 ...
MW:     362.168410 g/mol MF: C14H11IN4
IUPAC name: 4-N-(3-iodophenyl)quinazoline-4,7-diamine
Create Date: 2006-01-30
CID: 5328194

750. CHEMBL328955; 4-N-(3-chlorophenyl)quinazoline-4,7-diamine; PD153035 Analog 19 ...
MW:     270.716940 g/mol MF: C14H11ClN4
IUPAC name: 4-N-(3-chlorophenyl)quinazoline-4,7-diamine
Create Date: 2006-01-30
CID: 5328193

751. CHEMBL93966; 4-N-(3-fluorophenyl)quinazoline-4,7-diamine; PD153035 Analog 18 ...
MW:     254.262343 g/mol MF: C14H11FN4
IUPAC name: 4-N-(3-fluorophenyl)quinazoline-4,7-diamine
Create Date: 2006-01-30
CID: 5328192

752. CHEMBL330224; 4-N-phenylquinazoline-4,7-diamine; PD153035 Analog 17 ...
MW:     236.271880 g/mol MF: C14H12N4
IUPAC name: 4-N-phenylquinazoline-4,7-diamine
Create Date: 2006-01-30
CID: 5328191

753. CHEMBL92398; 7-methoxy-N-phenylquinazolin-4-amine; PD153035 Analog 15 ...
MW:     251.283220 g/mol MF: C15H13N3O
IUPAC name: 7-methoxy-N-phenylquinazolin-4-amine
Create Date: 2006-01-30
CID: 5328190

754. 6-Nitro-N-phenylquinazolin-4-amine; CHEMBL328295; PD153035 Analog 12 ...
MW:     266.254800 g/mol MF: C14H10N4O2
IUPAC name: 6-nitro-N-phenylquinazolin-4-amine
Create Date: 2006-01-30
CID: 5328189

755. CHEMBL328244; 4-N-[3-(trifluoromethyl)phenyl]quinazoline-4,6-diamine; PD153035 Analog 10 ...
MW:     304.269850 g/mol MF: C15H11F3N4
IUPAC name: 4-N-[3-(trifluoromethyl)phenyl]quinazoline-4,6-diamine
Create Date: 2006-01-30
CID: 5328188

756. 20927-57-5; 4-phenyl-2,3-dihydro-1H-1,5-benzodiazepine; 2,3-Dihydro-4-phenyl-1H-1,5-benzodiazepine ...
MW:     222.285060 g/mol MF: C15H14N2
IUPAC name: 4-phenyl-2,3-dihydro-1H-1,5-benzodiazepine
Create Date: 2005-07-19
CID: 2771646

757. Thioridazine disulfoxide analog; Mesoridazine sulfoxide; AC1LBZQG ...
MW:     402.573340 g/mol MF: C21H26N2O2S2
IUPAC name: 10-[2-(1-methylpiperidin-2-yl)ethyl]-2-methylsulfinylphenoth...
Create Date: 2005-03-27
CID: 567069

758. Indinavir analog; AC1LAJCJ
MW:     631.779943 g/mol MF: C36H46FN5O4
IUPAC name: (2S)-1-[(2R,3R,4S)-4-benzyl-3-fluoro-2-hydroxy-5-[[(1S,2R)-2...
Create Date: 2005-08-01
CID: 489318

759. Furan analog; AC1LA58Z; CTK8A5020 ...
MW:     440.493760 g/mol MF: C26H24N4O3
IUPAC name: 2-[2-[4-[5-[4-[1-(2-hydroxyethyl)imidazol-2-yl]phenyl]furan-...
Create Date: 2005-08-01
CID: 481737

760. Inosine analog; AC1LAIHE; CTK7J7456 ...
MW:     246.265160 g/mol MF: C12H14N4O2
IUPAC name: 9-[(1R,5R)-5-(hydroxymethyl)cyclohex-2-en-1-yl]-3H-purin-6-o...
Create Date: 2005-08-01
CID: 469075

761. [(1R,5R)-5-(6-aminopurin-9-yl)cyclohex-3-en-1-yl]methanol; Adenosine analog; AC1LAIHB ...
MW:     245.280400 g/mol MF: C12H15N5O
IUPAC name: [(1R,5R)-5-(6-aminopurin-9-yl)cyclohex-3-en-1-yl]methanol
Create Date: 2005-08-01
CID: 469074

762. (2R,3R)-3,5,7,8-Tetrahydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one; Flavanone analog; AC1LAI58 ...
MW:     304.251580 g/mol MF: C15H12O7
IUPAC name: (2R,3R)-3,5,7,8-tetrahydroxy-2-(4-hydroxyphenyl)-2,3-dihydro...
Create Date: 2005-08-01
CID: 468911

763. 2-[(4-sulfamoylphenyl)carbamoyl]benzenesulfinic acid; Benzamide analog; AC1LA75E ...
MW:     340.374780 g/mol MF: C13H12N2O5S2
IUPAC name: 2-[(4-sulfamoylphenyl)carbamoyl]benzenesulfinic acid
Create Date: 2005-08-01
CID: 462920

764. NSC619228; Myroridin analog; AC1L7DRY ...
MW:    1011.139660 g/mol MF: C41H74N18O12
IUPAC name: 2-[[2-[[5-amino-2-[[2-[[5-amino-2-[[2-[[2-amino-5-(diaminome...
Create Date: 2005-03-26
CID: 359015

765. pd 156273; CHEMBL92937; 4-N-(3-bromophenyl)-7-N-methylquinazoline-4,6,7-triamine ...
MW:     344.209160 g/mol MF: C15H14BrN5
IUPAC name: 4-N-(3-bromophenyl)-7-N-methylquinazoline-4,6,7-triamine
Create Date: 2005-03-25
CID: 4706

766. Lipid I analogue
MW:    1384.569964 g/mol MF: C66H111N7O20P2
IUPAC name: (2R)-5-[[(2S,5R)-5-[(2R,3R,4R,5S,6R)-3-acetamido-2-[[[(2Z,6Z...
Create Date: 2015-12-18
CID: 101247072

767. CHEMBL60072; Sulfircin analogue; BDBM50286608 ...
MW:     451.639160 g/mol MF: C25H39O5S-
IUPAC name: [(2S,3R)-1-[(1S,4aS,8aS)-2,5,5,8a-tetramethyl-1,4,4a,6,7,8-h...
Create Date: 2015-10-14
CID: 91934862

768. oxime analog 27; BDBM12338; 6-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-[(1E)-(hydroxyimino)methyl]pyrimidin-4-amine
MW:     301.275783 g/mol MF: C14H12FN5O2
IUPAC name: 6-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-(nitrosomethyl)py...
Create Date: 2015-03-16
CID: 90887398

769. Neopsicaine; UNII-17U5T727GW; Neopseudococaine ...
MW:     331.406100 g/mol MF: C19H25NO4
IUPAC name: propyl (1S,3S,4S,5R)-3-benzoyloxy-8-methyl-8-azabicyclo[3.2....
Create Date: 2014-07-05
CID: 75124282

770. Palladium analogue; CHEMBL313246; BDBM50071643
MW:     518.905200 g/mol MF: C28H20N4Pd
Create Date: 2011-01-19
CID: 49837842

771. CHEMBL269432; Bombesin analogue; BDBM50288252
MW:    1017.177180 g/mol MF: C51H72N10O12
IUPAC name: (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2...
Create Date: 2009-11-19
CID: 44322138

772. Sirolimus analogue; FK-506-M; BDBM50068561 ...
MW:     944.197840 g/mol MF: C52H81NO14
Create Date: 2009-11-19
CID: 44284311

773. Suvorexant; MK-4305; 1030377-33-3 ...
MW:     450.920720 g/mol MF: C23H23ClN6O2
IUPAC name: [(7R)-4-(5-chloro-1,3-benzoxazol-2-yl)-7-methyl-1,4-diazepan...
Create Date: 2008-10-20
CID: 24965990

774. indole analog 4c; CHEMBL194073; BDBM14452 ...
MW:     438.522480 g/mol MF: C30H22N4
IUPAC name: 4-[[5-[(5-naphthalen-1-ylindol-1-yl)methyl]imidazol-1-yl]met...
Create Date: 2008-01-19
CID: 23646778

775. oxime analog 29; CHEMBL222076; SCHEMBL12303506 ...
MW:     359.354923 g/mol MF: C17H18FN5O3
IUPAC name: 3-[(E)-[4-amino-6-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]pyri...
Create Date: 2008-01-19
CID: 23646068

776. oxime analog 28; CHEMBL220890; SCHEMBL12303464 ...
MW:     345.328343 g/mol MF: C16H16FN5O3
IUPAC name: 2-[(E)-[4-amino-6-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]pyri...
Create Date: 2008-01-19
CID: 23646067

777. oxime analog 26; CHEMBL220951; SCHEMBL12303505 ...
MW:     373.381503 g/mol MF: C18H20FN5O3
IUPAC name: 6-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-[(E)-3-methoxypro...
Create Date: 2008-01-19
CID: 23646065

778. oxime analog 25; CHEMBL219983; SCHEMBL12303499 ...
MW:     359.354923 g/mol MF: C17H18FN5O3
IUPAC name: 6-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-[(E)-2-methoxyeth...
Create Date: 2008-01-19
CID: 23646064

779. oxime analog 24; CHEMBL220444; SCHEMBL12303469 ...
MW:     386.423323 g/mol MF: C19H23FN6O2
IUPAC name: 5-[(E)-3-(dimethylamino)propoxyiminomethyl]-6-[(4-fluoro-2-m...
Create Date: 2008-01-19
CID: 23646063

780. oxime analog 23; CHEMBL220391; SCHEMBL12303470 ...
MW:     414.433423 g/mol MF: C20H23FN6O3
IUPAC name: 6-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-[(E)-2-morpholin-...
Create Date: 2008-01-19
CID: 23646062

781. oxime analog 22; CHEMBL223086; SCHEMBL12303467 ...
MW:     398.434023 g/mol MF: C20H23FN6O2
IUPAC name: 6-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-[(E)-2-pyrrolidin...
Create Date: 2008-01-19
CID: 23646061

782. oxime analog 21; CHEMBL222828; SCHEMBL12303466 ...
MW:     372.396743 g/mol MF: C18H21FN6O2
IUPAC name: 5-[(E)-2-(dimethylamino)ethoxyiminomethyl]-6-[(4-fluoro-2-me...
Create Date: 2008-01-19
CID: 23646060

783. oxime analog 20; CHEMBL223535; SCHEMBL12303478 ...
MW:     358.370163 g/mol MF: C17H19FN6O2
IUPAC name: 6-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-[(E)-2-(methylami...
Create Date: 2008-01-19
CID: 23646059

784. oxime analog 19; CHEMBL435748; SCHEMBL12303516 ...
MW:     391.398323 g/mol MF: C21H18FN5O2
IUPAC name: 6-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-[(E)-phenylmethox...
Create Date: 2008-01-19
CID: 23646058

785. oxime analog 18; CHEMBL219677; SCHEMBL12303510 ...
MW:     397.445963 g/mol MF: C21H24FN5O2
IUPAC name: 5-[(E)-cyclohexylmethoxyiminomethyl]-6-[(4-fluoro-2-methyl-1...
Create Date: 2008-01-19
CID: 23646057

786. oxime analog 17; CHEMBL219676; SCHEMBL12303501 ...
MW:     339.323763 g/mol MF: C17H14FN5O2
IUPAC name: 6-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-[(E)-prop-2-ynoxy...
Create Date: 2008-01-19
CID: 23646056

787. oxime analog 16; CHEMBL221224; SCHEMBL12303507 ...
MW:     341.339643 g/mol MF: C17H16FN5O2
IUPAC name: 6-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-[(E)-prop-2-enoxy...
Create Date: 2008-01-19
CID: 23646055

788. oxime analog 15; CHEMBL373826; SCHEMBL12303513 ...
MW:     357.382103 g/mol MF: C18H20FN5O2
IUPAC name: 5-[(E)-butoxyiminomethyl]-6-[(4-fluoro-2-methyl-1H-indol-5-y...
Create Date: 2008-01-19
CID: 23646054

789. oxime analog 14; CHEMBL426929; SCHEMBL12303514 ...
MW:     343.355523 g/mol MF: C17H18FN5O2
IUPAC name: 6-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-[(E)-propoxyimino...
Create Date: 2008-01-19
CID: 23646053

790. oxime analog 12; CHEMBL223622; SCHEMBL14363661 ...
MW:     301.275783 g/mol MF: C14H12FN5O2
IUPAC name: 6-[(6-fluoro-1H-indol-5-yl)oxy]-5-[(E)-methoxyiminomethyl]py...
Create Date: 2008-01-19
CID: 23646052

791. oxime analog 11; CHEMBL374240; SCHEMBL12303457 ...
MW:     301.275783 g/mol MF: C14H12FN5O2
IUPAC name: 6-[(4-fluoro-1H-indol-5-yl)oxy]-5-[(E)-methoxyiminomethyl]py...
Create Date: 2008-01-19
CID: 23646051

792. oxime analog 10; CHEMBL223534; SCHEMBL12303471 ...
MW:     297.311900 g/mol MF: C15H15N5O2
IUPAC name: 5-[(E)-methoxyiminomethyl]-6-[(3-methyl-1H-indol-5-yl)oxy]py...
Create Date: 2008-01-19
CID: 23646050

793. oxime analog 9; CHEMBL223486; SCHEMBL12303449 ...
MW:     297.311900 g/mol MF: C15H15N5O2
IUPAC name: 5-[(E)-methoxyiminomethyl]-6-[(2-methyl-1H-indol-5-yl)oxy]py...
Create Date: 2008-01-19
CID: 23646049

794. oxime analog 8; CHEMBL219729; SCHEMBL12303465 ...
MW:     297.311900 g/mol MF: C15H15N5O2
IUPAC name: 5-[(E)-methoxyiminomethyl]-6-(1-methylindol-5-yl)oxypyrimidi...
Create Date: 2008-01-19
CID: 23646048

795. oxime analog 7; CHEMBL387313; SCHEMBL12303461 ...
MW:     283.285320 g/mol MF: C14H13N5O2
IUPAC name: 6-(1H-indol-5-yloxy)-5-[(E)-methoxyiminomethyl]pyrimidin-4-a...
Create Date: 2008-01-19
CID: 23646047

796. oxime analog 6; CHEMBL219886; SCHEMBL12303456 ...
MW:     295.296020 g/mol MF: C15H13N5O2
IUPAC name: 5-[(E)-methoxyiminomethyl]-6-quinolin-7-yloxypyrimidin-4-ami...
Create Date: 2008-01-19
CID: 23646046

797. urea analog 3h; BDBM12144; N-({[4-(benzyloxy)phenyl]carbamoyl}amino)-4-sulfamoylbenzamide ...
MW:     440.472300 g/mol MF: C21H20N4O5S
IUPAC name: 1-(4-phenylmethoxyphenyl)-3-[(4-sulfamoylbenzoyl)amino]urea
Create Date: 2008-01-19
CID: 23646015

798. Isatin analog 4; BDBM10300; 2,3-Dioxo-1-methylindoline-5-carboxylate ...
MW:     204.158940 g/mol MF: C10H6NO4-
IUPAC name: 1-methyl-2,3-dioxoindole-5-carboxylate
Create Date: 2008-01-19
CID: 23645143

799. amide analog 29; CHEMBL124111; BDBM10207 ...
MW:     470.471840 g/mol MF: C24H26N2O8
IUPAC name: 5-[[6-[[(2S)-1-carboxy-3-oxopropan-2-yl]amino]-6-oxo-5-pheny...
Create Date: 2008-01-19
CID: 23645135

800. oxime analog 5; CHEMBL220523; SCHEMBL12303463 ...
MW:     295.296020 g/mol MF: C15H13N5O2
IUPAC name: 5-[(E)-methoxyiminomethyl]-6-quinolin-6-yloxypyrimidin-4-ami...
Create Date: 2008-01-19
CID: 23644667

801. Imide Analog 7; CHEMBL386636; BDBM14186 ...
MW:     338.358760 g/mol MF: C22H14N2O2
Create Date: 2007-06-18
CID: 16105510

802. oxime analog 13; CHEMBL223892; SCHEMBL12303445 ...
MW:     329.328943 g/mol MF: C16H16FN5O2
IUPAC name: 5-[(E)-ethoxyiminomethyl]-6-[(4-fluoro-2-methyl-1H-indol-5-y...
Create Date: 2007-05-29
CID: 16066844

803. urea analog 3b; CHEMBL368235; BDBM12138 ...
MW:     376.387040 g/mol MF: C16H16N4O5S
IUPAC name: 1-(4-acetylphenyl)-3-[(4-sulfamoylbenzoyl)amino]urea
Create Date: 2006-10-26
CID: 11463026

804. urea analog 3j; CHEMBL179021; BDBM12146 ...
MW:     422.457020 g/mol MF: C21H18N4O4S
IUPAC name: 1-(9H-fluoren-9-yl)-3-[(4-sulfamoylbenzoyl)amino]urea
Create Date: 2006-10-26
CID: 11441601

805. indole analog 4d; CHEMBL440564; BDBM14453 ...
MW:     463.531940 g/mol MF: C31H21N5
IUPAC name: 1-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]-5-naphtha...
Create Date: 2006-10-26
CID: 11408635

806. urea analog 3f; CHEMBL367378; BDBM12142 ...
MW:     410.446320 g/mol MF: C20H18N4O4S
IUPAC name: 1-(4-phenylphenyl)-3-[(4-sulfamoylbenzoyl)amino]urea
Create Date: 2006-10-26
CID: 11407223

807. urea analog 3i; CHEMBL175881; BDBM12145 ...
MW:     468.568520 g/mol MF: C24H28N4O4S
IUPAC name: 1-[4-(1-adamantyl)phenyl]-3-[(4-sulfamoylbenzoyl)amino]urea
Create Date: 2006-10-26
CID: 11317320

808. urea analog 3g; CHEMBL176283; BDBM12143 ...
MW:     426.445720 g/mol MF: C20H18N4O5S
IUPAC name: 1-(4-phenoxyphenyl)-3-[(4-sulfamoylbenzoyl)amino]urea
Create Date: 2006-10-26
CID: 11247335

809. urea analog 3c; CHEMBL367844; BDBM12139 ...
MW:     406.413020 g/mol MF: C17H18N4O6S
IUPAC name: ethyl 4-[[(4-sulfamoylbenzoyl)amino]carbamoylamino]benzoate
Create Date: 2006-10-26
CID: 11235150

810. urea analog 3e; CHEMBL369045; BDBM12141 ...
MW:     413.246420 g/mol MF: C14H13BrN4O4S
IUPAC name: 1-(4-bromophenyl)-3-[(4-sulfamoylbenzoyl)amino]urea
Create Date: 2006-10-26
CID: 11223689

811. urea analog 3a; CHEMBL179136; BDBM12137 ...
MW:     403.240480 g/mol MF: C14H12Cl2N4O4S
IUPAC name: 1-(3,4-dichlorophenyl)-3-[(4-sulfamoylbenzoyl)amino]urea
Create Date: 2006-10-26
CID: 11177131

812. urea analog 3d; CHEMBL369179; BDBM12140 ...
MW:     379.347920 g/mol MF: C14H13N5O6S
IUPAC name: 1-(4-nitrophenyl)-3-[(4-sulfamoylbenzoyl)amino]urea
Create Date: 2006-10-26
CID: 11164855

813. Imide Analog 4; CHEMBL219159; SCHEMBL3075228 ...
MW:     324.332180 g/mol MF: C21H12N2O2
Create Date: 2006-10-26
CID: 11012763

814. 5-NITRO-1-BENZYL-ISATIN; 1-Benzyl-5-nitroindoline-2,3-dione; 99448-81-4 ...
MW:     282.250900 g/mol MF: C15H10N2O4
IUPAC name: 1-benzyl-5-nitroindole-2,3-dione
Create Date: 2006-10-26
CID: 10826725

815. furanyl analog 2; BDBM9121; CHEMBL444533 ...
MW:     721.765190 g/mol MF: C38H42F3N5O6
IUPAC name: (2S)-1-[(2S,4R)-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4-dihydro-...
Create Date: 2006-10-25
CID: 9940105

816. Rhodanine-thiophene analogue 24; AC1O6ZYO; BDBM8459 ...
MW:     367.486160 g/mol MF: C14H9NO3S4
IUPAC name: 2-[(5Z)-4-oxo-2-sulfanylidene-5-[(5-thiophen-2-ylthiophen-2-...
Create Date: 2006-05-10
CID: 6539648

817. Rhodanine-thiophene analogue 12; AC1O6ZY2; BDBM8447 ...
MW:     486.585400 g/mol MF: C16H10N2O6S5
IUPAC name: 2-[(5Z)-5-[[5-[(Z)-[3-(carboxymethyl)-4-oxo-2-sulfanylidene-...
Create Date: 2006-05-10
CID: 6539637

818. Rhodanine-thiophene analogue 11; 2-[(5Z)-5-[[5-(4-chlorophenyl)thiophen-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid; 2-[(5Z)-5-{[5-(4-chlorophenyl)thiophen-2-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid ...
MW:     395.903500 g/mol MF: C16H10ClNO3S3
IUPAC name: 2-[(5Z)-5-[[5-(4-chlorophenyl)thiophen-2-yl]methylidene]-4-o...
Create Date: 2006-05-10
CID: 6539636

819. CHEMBL103838; 1,2,4-Oxadiazole Analogue 5f; AC1O3EHX ...
MW:     556.428232 g/mol MF: C23H24F3N4O7P
IUPAC name: [4-[(2S)-2-acetamido-3-oxo-3-[[(1S)-1-[3-[[4-(trifluoromethy...
Create Date: 2006-01-30
CID: 6326464

820. 1,2,4-Oxadiazole Analogue 5j; AC1O3EHI; BDBM5071 ...
MW:     614.326792 g/mol MF: C22H24IN4O7P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-1-[3-[(4-iodophenyl)methyl]-1,...
Create Date: 2006-01-30
CID: 6326459

821. 1,2,4-Oxadiazole Analogue 5c; AC1O3EHF; BDBM5070 ...
MW:     522.875322 g/mol MF: C22H24ClN4O7P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-1-[3-[(3-chlorophenyl)methyl]-...
Create Date: 2006-01-30
CID: 6326458

822. 1,2,4-Oxadiazole Analogue 5i; AC1O3EHC; BDBM5069 ...
MW:     567.326322 g/mol MF: C22H24BrN4O7P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-1-[3-[(4-bromophenyl)methyl]-1...
Create Date: 2006-01-30
CID: 6326457

823. 1,2,4-Oxadiazole Analogue 5h; AC1O3EH9; BDBM5068 ...
MW:     506.420725 g/mol MF: C22H24FN4O7P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-1-[3-[(4-fluorophenyl)methyl]-...
Create Date: 2006-01-30
CID: 6326456

824. 1,2,4-Oxadiazole Analogue 5b; AC1O3EH6; BDBM5066 ...
MW:     522.875322 g/mol MF: C22H24ClN4O7P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-1-[3-[(4-chlorophenyl)methyl]-...
Create Date: 2006-01-30
CID: 6326455

825. 1,2,4-Oxadiazole Analogue 5a; AC1O3EH3; BDBM5065 ...
MW:     502.456842 g/mol MF: C23H27N4O7P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-1-[3-[(4-methylphenyl)methyl]-...
Create Date: 2006-01-30
CID: 6326454

826. Kazusamycin B; NSC606865; 107140-30-7 ...
MW:     542.703440 g/mol MF: C32H46O7
IUPAC name: (2E,10E,12E,16E,18E)-6-hydroxy-9-(hydroxymethyl)-3,5,7,11,15...
Create Date: 2005-03-26
CID: 5386313

827. Conocurvone Analog; AC1NS4QE; NSC650892 ...
MW:     802.862480 g/mol MF: C50H42O10
IUPAC name: 7-hydroxy-8-[3-[7-hydroxy-3-methyl-3-(4-methylpent-3-enyl)-9...
Create Date: 2005-03-25
CID: 5353945

828. BMS-387032 analog 25; AC1NS7XW; BDBM5935 ...
MW:     480.643880 g/mol MF: C22H32N4O4S2
IUPAC name: tert-butyl 4-[[5-[(5-tert-butyl-1,3-oxazol-2-yl)methylsulfan...
Create Date: 2006-01-30
CID: 5329926

829. BMS-387032 analog 24; AC1NS7XT; CHEMBL47116 ...
MW:     458.618440 g/mol MF: C18H26N4O4S3
IUPAC name: N-[5-[(5-tert-butyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thia...
Create Date: 2006-01-30
CID: 5329925

830. BMS-387032 analog 23; AC1NS7XQ; CHEMBL49814 ...
MW:     424.580620 g/mol MF: C19H28N4O3S2
IUPAC name: N-[5-[(5-tert-butyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thia...
Create Date: 2006-01-30
CID: 5329924

831. BMS-387032 analog 22; AC1NS7XN; BDBM5932 ...
MW:     394.554640 g/mol MF: C18H26N4O2S2
IUPAC name: N-[5-[(5-tert-butyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thia...
Create Date: 2006-01-30
CID: 5329923

832. BMS-387032 analog 20; AC1NS7XK; CHEMBL45757 ...
MW:     394.554640 g/mol MF: C18H26N4O2S2
IUPAC name: N-[5-[(5-tert-butyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thia...
Create Date: 2006-01-30
CID: 5329922

833. CHEMBL297570; BMS-387032 analog 19; AC1NS7XH ...
MW:     380.528060 g/mol MF: C17H24N4O2S2
IUPAC name: N-[5-[(5-tert-butyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thia...
Create Date: 2006-01-30
CID: 5329921

834. BMS-387032 analog 18; AC1NS7XE; CHEMBL46164 ...
MW:     366.501480 g/mol MF: C16H22N4O2S2
IUPAC name: N-[5-[(5-tert-butyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thia...
Create Date: 2006-01-30
CID: 5329920

835. BMS-387032 analog 17; AC1NS7XB; CHEMBL47800 ...
MW:     379.540000 g/mol MF: C18H25N3O2S2
IUPAC name: N-[5-[(5-tert-butyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thia...
Create Date: 2006-01-30
CID: 5329919

836. BMS-387032 analog 16; AC1NS7X8; BDBM5926 ...
MW:     393.566580 g/mol MF: C19H27N3O2S2
IUPAC name: N-[5-[(5-tert-butyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thia...
Create Date: 2006-01-30
CID: 5329918

837. BMS-387032 analog 14; AC1NS7X5; CHEMBL45860 ...
MW:     387.518940 g/mol MF: C19H21N3O2S2
IUPAC name: N-[5-[(5-tert-butyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thia...
Create Date: 2006-01-30
CID: 5329917

838. BMS-387032 analog 13; AC1NS7X2; BDBM5923 ...
MW:     340.464200 g/mol MF: C14H20N4O2S2
IUPAC name: 3-amino-N-[5-[(5-tert-butyl-1,3-oxazol-2-yl)methylsulfanyl]-...
Create Date: 2006-01-30
CID: 5329916

839. 1,2,4-Oxadiazole Analogue 5e; AC1NS6BC; BDBM5096 ...
MW:     538.488942 g/mol MF: C26H27N4O7P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-1-[3-(naphthalen-2-ylmethyl)-1...
Create Date: 2006-01-30
CID: 5329218

840. CHEMBL318300; 1,2,4-Oxadiazole Analogue 5d; AC1NS6B9 ...
MW:     557.320382 g/mol MF: C22H23Cl2N4O7P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-1-[3-[(3,4-dichlorophenyl)meth...
Create Date: 2006-01-30
CID: 5329217

841. 1,2,4-Oxadiazole Analogue 4j; AC1NS6B6; BDBM5094 ...
MW:     595.540262 g/mol MF: C28H30N5O8P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-4-amino-1-[3-(naphthalen-2-ylm...
Create Date: 2006-01-30
CID: 5329216

842. 1,2,4-Oxadiazole Analogue 4f; AC1NS6B3; BDBM5093 ...
MW:     614.371702 g/mol MF: C24H26Cl2N5O8P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-4-amino-1-[3-[(3,4-dichlorophe...
Create Date: 2006-01-30
CID: 5329215

843. CHEMBL77067; 1,2,4-Oxadiazole Analogue 4a; AC1NS6B0 ...
MW:     545.481582 g/mol MF: C24H28N5O8P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-4-amino-1-(3-benzyl-1,2,4-oxad...
Create Date: 2006-01-30
CID: 5329214

844. 1,2,4-Oxadiazole Analogue 11; AC1NS6AF; BDBM5081 ...
MW:     570.454812 g/mol MF: C24H26F3N4O7P
IUPAC name: [4-[(2S)-2-acetamido-3-oxo-3-[[(1S)-1-[3-[[4-(trifluoromethy...
Create Date: 2006-01-30
CID: 5329203

845. 1,2,4-Oxadiazole Analogue 10; AC1NS6AC; BDBM5080 ...
MW:     671.560232 g/mol MF: C31H29F3N5O7P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-2-(1H-indol-3-yl)-1-[3-[[4-(tr...
Create Date: 2006-01-30
CID: 5329202

846. 1,2,4-Oxadiazole Analogue 9; AC1NS6A9; BDBM5079 ...
MW:     599.452972 g/mol MF: C24H25F3N5O8P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-3-amino-3-oxo-1-[3-[[4-(triflu...
Create Date: 2006-01-30
CID: 5329201

847. 1,2,4-Oxadiazole Analogue 8; AC1NS6A6; BDBM5078 ...
MW:     556.428232 g/mol MF: C23H24F3N4O7P
IUPAC name: [4-[(2S)-2-acetamido-3-oxo-3-[2-[3-[[4-(trifluoromethyl)phen...
Create Date: 2006-01-30
CID: 5329200

848. 1,2,4-Oxadiazole Analogue 7; AC1NS6A3; BDBM5077 ...
MW:     542.401652 g/mol MF: C22H22F3N4O7P
IUPAC name: [4-[(2S)-2-acetamido-3-oxo-3-[[3-[[4-(trifluoromethyl)phenyl...
Create Date: 2006-01-30
CID: 5329199

849. 1,2,4-Oxadiazole Analogue 6; AC1NS6A0; BDBM5076 ...
MW:     570.454812 g/mol MF: C24H26F3N4O7P
IUPAC name: [4-[(2S)-2-acetamido-3-oxo-3-[2-[3-[[4-(trifluoromethyl)phen...
Create Date: 2006-01-30
CID: 5329198

850. 1,2,4-Oxadiazole Analogue 5n; AC1NS69X; BDBM5075 ...
MW:     693.222852 g/mol MF: C22H23BrIN4O7P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-1-[3-[(3-bromo-4-iodophenyl)me...
Create Date: 2006-01-30
CID: 5329197

851. 1,2,4-Oxadiazole Analogue 5m; AC1NS69U; BDBM5074 ...
MW:     648.771852 g/mol MF: C22H23ClIN4O7P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-1-[3-[(3-chloro-4-iodophenyl)m...
Create Date: 2006-01-30
CID: 5329196

852. 1,2,4-Oxadiazole Analogue 5l; AC1NS69R; BDBM5073 ...
MW:     601.771382 g/mol MF: C22H23BrClN4O7P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-1-[3-[(3-bromo-4-chlorophenyl)...
Create Date: 2006-01-30
CID: 5329195

853. 1,2,4-Oxadiazole Analogue 5k; AC1NS69O; BDBM5072 ...
MW:     646.222382 g/mol MF: C22H23Br2N4O7P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-1-[3-[(3,4-dibromophenyl)methy...
Create Date: 2006-01-30
CID: 5329194

854. 1,2,4-Oxadiazole Analogue 5g; AC1NS69L; BDBM5067 ...
MW:     556.428232 g/mol MF: C23H24F3N4O7P
IUPAC name: [4-[(2S)-2-acetamido-3-oxo-3-[[(1S)-1-[3-[[3-(trifluoromethy...
Create Date: 2006-01-30
CID: 5329189

855. CHEMBL76963; 1,2,4-Oxadiazole Analogue 4k; AC1NS69I ...
MW:     559.508162 g/mol MF: C25H30N5O8P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-4-amino-4-oxo-1-[3-(2-phenylet...
Create Date: 2006-01-30
CID: 5329186

856. CHEMBL310313; 1,2,4-Oxadiazole Analogue 4i; AC1NS69F ...
MW:     595.540262 g/mol MF: C28H30N5O8P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-4-amino-1-[3-(naphthalen-1-ylm...
Create Date: 2006-01-30
CID: 5329185

857. 1,2,4-Oxadiazole Analogue 4h; AC1NS69C; BDBM5062 ...
MW:     587.561322 g/mol MF: C27H34N5O8P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-4-amino-4-oxo-1-[3-[(2,4,6-tri...
Create Date: 2006-01-30
CID: 5329184

858. 1,2,4-Oxadiazole Analogue 4g; AC1NS699; BDBM5061 ...
MW:     614.371702 g/mol MF: C24H26Cl2N5O8P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-4-amino-1-[3-[(2,4-dichlorophe...
Create Date: 2006-01-30
CID: 5329183

859. 1,2,4-Oxadiazole Analogue 4e; AC1NS696; BDBM5060 ...
MW:     579.926642 g/mol MF: C24H27ClN5O8P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-4-amino-1-[3-[(3-chlorophenyl)...
Create Date: 2006-01-30
CID: 5329182

860. 1,2,4-Oxadiazole Analogue 4d; AC1NS693; BDBM5059 ...
MW:     579.926642 g/mol MF: C24H27ClN5O8P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-4-amino-1-[3-[(4-chlorophenyl)...
Create Date: 2006-01-30
CID: 5329181

861. 1,2,4-Oxadiazole Analogue 4c; AC1NS690; BDBM5058 ...
MW:     587.561322 g/mol MF: C27H34N5O8P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-4-amino-4-oxo-1-[3-[(4-propan-...
Create Date: 2006-01-30
CID: 5329180

862. 1,2,4-Oxadiazole Analogue 4b; AC1NS68X; BDBM5057 ...
MW:     559.508162 g/mol MF: C25H30N5O8P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-4-amino-1-[3-[(4-methylphenyl)...
Create Date: 2006-01-30
CID: 5329179

863. Acyclic Balanol Analog 12c(S); AC1NS3GH; BDBM3203 ...
MW:     621.611180 g/mol MF: C31H27NO11S
IUPAC name: [(2S)-2-(benzenesulfonamido)-3-(4-hydroxyphenyl)propyl] 3,5-...
Create Date: 2006-01-30
CID: 5327962

864. 4,1-Benzoxazepinone analogue 2q; AC1NS32K; BDBM2921 ...
MW:     347.279876 g/mol MF: C16H14F5NO2
IUPAC name: (3S,5S)-5-[(E)-2-cyclopropylethenyl]-6,7-difluoro-3-methyl-5...
Create Date: 2006-01-30
CID: 5327782

865. 4,1-Benzoxazepinone analogue 1q; AC1NS32H; BDBM2920 ...
MW:     345.263996 g/mol MF: C16H12F5NO2
IUPAC name: (3S,5S)-5-(2-cyclopropylethynyl)-6,7-difluoro-3-methyl-5-(tr...
Create Date: 2006-01-30
CID: 5327781

866. 4,1-Benzoxazepinone analogue 2e; CHEMBL29171; AC1NS322 ...
MW:     331.717430 g/mol MF: C15H13ClF3NO2
IUPAC name: 7-chloro-5-[(E)-2-cyclopropylethenyl]-5-(trifluoromethyl)-1H...
Create Date: 2006-01-30
CID: 5327776

867. LY300046HCl Analog 39; AC1NS2Q3; BDBM2153 ...
MW:     377.262220 g/mol MF: C14H13BrN6S
IUPAC name: 1-[2-(benzotriazol-2-yl)ethyl]-3-(5-bromopyridin-2-yl)thiour...
Create Date: 2006-01-30
CID: 5327629

868. PT-109; 1-(5-chloropyridin-2-yl)-3-[2-(2,4,6-trifluorophenyl)ethyl]thiourea; LY300046HCl Analog 29 ...
MW:     345.770450 g/mol MF: C14H11ClF3N3S
IUPAC name: 1-(5-chloropyridin-2-yl)-3-[2-(2,4,6-trifluorophenyl)ethyl]t...
Create Date: 2006-01-30
CID: 5327628

869. BMS-186318 analog 15; AC1NS2D9; BDBM678 ...
MW:     631.756860 g/mol MF: C33H49N3O9
IUPAC name: 3-[4-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-3-[(2-methylpr...
Create Date: 2006-01-30
CID: 5327442

870. 5-Nitroisatin; 611-09-6; 5-Nitroindoline-2,3-dione ...
MW:     192.128360 g/mol MF: C8H4N2O4
IUPAC name: 5-nitro-1H-indole-2,3-dione
Create Date: 2005-03-26
CID: 4669250

871. CHEMBL108221; QXPT analog; AC1MHE9W ...
MW:     442.332240 g/mol MF: C19H16BrN5OS
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-(4-oxopyrrolo[1,2-a]quinoxalin-...
Create Date: 2005-08-01
CID: 3002309

872. CHEMBL64584; 1H-Indole-5-carbonitrile, 2,3-dihydro-1-methyl-2,3-dioxo-; Isatin analog 7 ...
MW:     186.166840 g/mol MF: C10H6N2O2
IUPAC name: 1-methyl-2,3-dioxoindole-5-carbonitrile
Create Date: 2005-08-01
CID: 515953

873. CHEMBL64582; methyl 1-methyl-2,3-dioxoindoline-5-carboxylate; methyl 1-methyl-2,3-dioxoindole-5-carboxylate ...
MW:     219.193460 g/mol MF: C11H9NO4
IUPAC name: methyl 1-methyl-2,3-dioxoindole-5-carboxylate
Create Date: 2005-08-01
CID: 515952

874. 1-methyl-5-nitro-isatin; 3484-32-0; 1-Methyl-5-nitroindoline-2,3-dione ...
MW:     206.154940 g/mol MF: C9H6N2O4
IUPAC name: 1-methyl-5-nitroindole-2,3-dione
Create Date: 2005-08-01
CID: 515950

875. CHEMBL64413; 5-iodo-1-methylindoline-2,3-dione; 76034-84-9 ...
MW:     287.053910 g/mol MF: C9H6INO2
IUPAC name: 5-iodo-1-methylindole-2,3-dione
Create Date: 2005-08-01
CID: 515949

876. (3R,5S)-5-(2-cyclopropylethynyl)-3-ethyl-7-fluoro-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one; 4,1-Benzoxazepinone analogue 1m; AC1LAEQZ ...
MW:     341.300113 g/mol MF: C17H15F4NO2
IUPAC name: (3R,5S)-5-(2-cyclopropylethynyl)-3-ethyl-7-fluoro-5-(trifluo...
Create Date: 2005-08-01
CID: 486698

877. (3R,5S)-5-(2-cyclopropylethynyl)-7-fluoro-3-methyl-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one; 4,1-Benzoxazepinone analogue 1l; AC1LAEQW ...
MW:     327.273533 g/mol MF: C16H13F4NO2
IUPAC name: (3R,5S)-5-(2-cyclopropylethynyl)-7-fluoro-3-methyl-5-(triflu...
Create Date: 2005-08-01
CID: 486697

878. (3S,5S)-7-chloro-5-(2-cyclopropylethynyl)-3-methyl-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one; 4,1-Benzoxazepinone analogue 1f; AC1LAEQE ...
MW:     343.728130 g/mol MF: C16H13ClF3NO2
IUPAC name: (3S,5S)-7-chloro-5-(2-cyclopropylethynyl)-3-methyl-5-(triflu...
Create Date: 2005-08-01
CID: 486691

879. 2,7-Bis[3-(dimethylamino)propoxy]fluoren-9-one; Fluorenone analog; AC1LA67I ...
MW:     382.495900 g/mol MF: C23H30N2O3
IUPAC name: 2,7-bis[3-(dimethylamino)propoxy]fluoren-9-one
Create Date: 2005-08-01
CID: 482202

880. Phosphonate analog; AC1L9TNA; CHEMBL332177 ...
MW:     315.222422 g/mol MF: C10H14N5O5P
IUPAC name: [(2R,5S)-5-[(2-amino-6-oxo-3H-purin-9-yl)methyl]oxolan-2-yl]...
Create Date: 2005-08-01
CID: 475766

881. ddI/TPFA analog; AC1L9STG; CTK7B4365 ...
MW:     374.309462 g/mol MF: C12H15N4O6PS
IUPAC name: [methoxy-[[(2S,5R)-5-(6-oxo-3H-purin-9-yl)oxolan-2-yl]methox...
Create Date: 2005-08-01
CID: 475374

882. ddA/TPFA analog; AC1L9STD; CTK7B4366 ...
MW:     373.324702 g/mol MF: C12H16N5O5PS
IUPAC name: [[(2S,5R)-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-methoxyph...
Create Date: 2005-08-01
CID: 475373

883. ddI/PFA analog; AC1L9STA; CTK7B4367 ...
MW:     388.336042 g/mol MF: C13H17N4O6PS
IUPAC name: methyl [methoxy-[[(2S,5R)-5-(6-oxo-3H-purin-9-yl)oxolan-2-yl...
Create Date: 2005-08-01
CID: 475372

884. ddA/PFA analog; AC1L9ST7; Methyl, 2',3'-dideoxyadenosine-5'-(methoxyphosphoryl)formate ...
MW:     387.351282 g/mol MF: C13H18N5O5PS
IUPAC name: methyl [[(2S,5R)-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-me...
Create Date: 2005-08-01
CID: 475371

885. [(9R,10R)-8,8-dimethyl-2-oxo-4-(trifluoromethyl)-9-(1,7,7-trimethyl-2-oxo-3-oxabicyclo[2.2.1]heptane-4-carbonyl)oxy-9,10-dihydropyrano[2,3-f]chromen-10-yl] 1,7,7-trimethyl-2-oxo-3-oxabicyclo[2.2.1]heptane-4-carboxylate; DCK analog; AC1L9S9S ...
MW:     690.656890 g/mol MF: C35H37F3O11
IUPAC name: [(9R,10R)-8,8-dimethyl-2-oxo-4-(trifluoromethyl)-9-(1,7,7-tr...
Create Date: 2005-08-01
CID: 475105

886. CHEMBL341024; Nelfinavir analog; AC1LALY3 ...
MW:     617.841080 g/mol MF: C36H47N3O4S
IUPAC name: (3S,4aS,8aS)-N-tert-butyl-2-[(2R,3R)-2-hydroxy-3-[(3-hydroxy...
Create Date: 2005-08-01
CID: 470863

887. TCRB analog; AC1LAK2G; CTK7J7579 ...
MW:     403.644420 g/mol MF: C16H13Cl3N2O4
IUPAC name: (2R,3S,4R,5R)-2-(hydroxymethyl)-5-(2,6,7-trichlorobenzo[f]be...
Create Date: 2005-08-01
CID: 469860

888. R 87366; R-87366; 144779-91-9 ...
MW:     617.695360 g/mol MF: C32H39N7O6
IUPAC name: (2S)-N-[(2S,3S)-4-[(2S)-2-(tert-butylcarbamoyl)pyrrolidin-1-...
Create Date: 2005-08-01
CID: 464206

889. Dipyridodiazepinone deriv. 17; Nevarapine analog; AC1LA2BK ...
MW:     300.742920 g/mol MF: C15H13ClN4O
IUPAC name: 2-chloro-11-cyclopropyl-5-methyldipyrido[2,3-b:2',4'-f][1,4]...
Create Date: 2005-08-01
CID: 460382

890. Haloperidol analog; AC1L9R5Q; SCHEMBL8986040 ...
MW:     433.969720 g/mol MF: C27H28ClNO2
IUPAC name: 4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-1-(4-phenylph...
Create Date: 2005-08-01
CID: 453748

891. 9-(Methoxy-(4-hydroxybuten-3-yl)-guanine; 136083-21-1; 6H-Purin-6-one, 2-amino-1,9-dihydro-9-(((1-(hydroxymethyl)-2-propenyl)oxy)methyl)- ...
MW:     251.241920 g/mol MF: C10H13N5O3
IUPAC name: 2-amino-9-(1-hydroxybut-3-en-2-yloxymethyl)-3H-purin-6-one
Create Date: 2005-08-01
CID: 453000

892. 1-(Methoxy-(4-hydroxybuten-3-yl)-thymine; 136083-22-2; 2,4(1H,3H)-Pyrimidinedione, 1-(((1-(hydroxymethyl)-2-propenyl)oxy)methyl)-5-methyl- ...
MW:     226.229160 g/mol MF: C10H14N2O4
IUPAC name: 1-(1-hydroxybut-3-en-2-yloxymethyl)-5-methylpyrimidine-2,4-d...
Create Date: 2005-08-01
CID: 452999

893. 9-(Methoxy-(4-hydroxybuten-3-yl)-adenine; 2-[(6-aminopurin-9-yl)methoxy]but-3-en-1-ol; 136083-19-7 ...
MW:     235.242520 g/mol MF: C10H13N5O2
IUPAC name: 2-[(6-aminopurin-9-yl)methoxy]but-3-en-1-ol
Create Date: 2005-08-01
CID: 452997

894. Stauffer R-1505; R 1505; ENT 25,706 ...
MW:     329.308602 g/mol MF: C13H16NO5PS
IUPAC name: 2-(diethoxyphosphorylsulfanylmethyl)isoindole-1,3-dione
Create Date: 2005-08-08
CID: 77321

895. Inactivin; Epi-Br; PPB2 ...
MW:     369.336360 g/mol MF: C19H29BrO2
IUPAC name: (3S,5S,8R,9S,10S,13S,14S,16R)-16-bromo-3-hydroxy-10,13-dimet...
Create Date: 2005-08-01
CID: 71613

896. BMS-186318; BMS 186318; 161302-40-5 ...
MW:     686.835360 g/mol MF: C36H54N4O9
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-3-[(2-...
Create Date: 2005-08-01
CID: 65024

897. N-Methylisatin; 1-Methylisatin; 2058-74-4 ...
MW:     161.157380 g/mol MF: C9H7NO2
IUPAC name: 1-methylindole-2,3-dione
Create Date: 2005-03-26
CID: 16358

898. ATP Analog; AC1L1IZ5; [[[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]-difluoromethyl]phosphonic acid ...
MW:     541.189132 g/mol MF: C11H16F2N5O12P3
IUPAC name: [[[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-h...
Create Date: 2005-03-25
CID: 4796

899. Lipid II analogue
MW:    1587.762484 g/mol MF: C74H124N8O25P2
IUPAC name: (2R)-5-[[(2S,5R)-5-[(2R,3R,4R,5S,6R)-3-acetamido-5-[(2S,3R,4...
Create Date: 2015-12-18
CID: 101247073

900. pyrazole analog 3o; BDBM12766; 1-(3-carbamimidoylphenyl)-N-[4-(2-oxo-2,7a-dihydro-1H-1,3-benzodiazol-1-yl)phenyl]-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
MW:     505.451330 g/mol MF: C25H18F3N7O2
IUPAC name: 2-(3-carbamimidoylphenyl)-N-[4-(2-oxo-3H-benzimidazol-1-yl)p...
Create Date: 2015-10-06
CID: 91895877

901. oxime analog, 9h; BDBM16926; (3E)-5-{5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]pyridin-3-yl}-3-(hydroxyimino)-2,3-dihydro-1H-indol-2-one
MW:     427.455240 g/mol MF: C24H21N5O3
IUPAC name: 5-[5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]pyridin-3-yl]-3-...
Create Date: 2015-03-16
CID: 90848486

902. CHEMBL2373069; actinomycin analogue; BDBM50071191
MW:    1269.443620 g/mol MF: C63H88N12O16
IUPAC name: 2-amino-9-N-[(3S,6S,7R,10S,16S)-3-[(2S)-butan-2-yl]-7,11,14-...
Create Date: 2014-04-03
CID: 73351843

903. Borrelidin analogue; CHEMBL2349172; (1R,2R)-2-[(2S,4E,6Z,8R,9S,11R,13S,15S,16S)-8,16-diacetoxy-7-cyano-9,11,13,15-tetramethyl-18-oxo-1-oxacyclooctadeca-4,6-dien-2-yl]cyclopentanecarboxylic acid
MW:     573.717480 g/mol MF: C32H47NO8
IUPAC name: (1R,2R)-2-[(2S,4E,6Z,8R,9S,11R,13S,15S,16S)-8,16-diacetyloxy...
Create Date: 2013-07-01
CID: 71580961

904. IGF-I Analog; JB1 trifluoroacetate salt; JB-1 trifluoroacetate salt ...
MW:    1249.502020 g/mol MF: C55H88N14O15S2
Create Date: 2013-05-17
CID: 71311995

905. Pyrido analog, 3; BDBM92626; FPX ...
MW:     529.512490 g/mol MF: C29H22F3N5O2
IUPAC name: N-[3-(2-anilino-8-methyl-7-oxopyrido[2,3-d]pyrimidin-6-yl)-4...
Create Date: 2012-08-30
CID: 60147016

906. Montelukast Gem-dimethylmethylene Analogue; SCHEMBL8496455; CTK8F0738 ...
MW:     588.199120 g/mol MF: C35H38ClNO3S
IUPAC name: 4-[(1R)-1-[3-[2-(7-chloroquinolin-2-yl)ethenyl]phenyl]-3-[2-...
Create Date: 2011-12-03
CID: 53656255

907. CHEMBL431814; Borolysine analogue; BDBM50288402
MW:     391.272900 g/mol MF: C18H30BN5O4
IUPAC name: [(1R)-4-[(N'-methylcarbamimidoyl)amino]-1-[[2-[methyl(3-phen...
Create Date: 2009-11-19
CID: 44330666

908. Naltrexone analogue; BDBM50013386; 4,5alpha-Epoxy-3,6alpha, 14-trihydroxy-6beta-(2-carboxyallyl)-17-(cyclopropylmethyl) morphinnan gama-lactone ...
MW:     409.474880 g/mol MF: C24H27NO5
IUPAC name: (12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-3'-methylidenesp...
Create Date: 2009-11-19
CID: 44292859

909. Ethyl analog, 4; SCHEMBL931385; SCHEMBL8930611 ...
MW:     363.432880 g/mol MF: C20H17N3O2S
IUPAC name: (6Z)-4-ethyl-3-hydroxy-6-(4-naphthalen-1-yl-5-sulfanylidene-...
Create Date: 2009-03-23
CID: 25191520

910. CHEMBL404321; NSC-748392; Cryptolepine analog ...
MW:     366.887120 g/mol MF: C21H23ClN4
IUPAC name: 5-methyl-N-piperidin-4-yl-10H-indolo[3,2-b]quinolin-5-ium-11...
Create Date: 2008-09-22
CID: 24901421

911. CHEMBL73418; amide analogue, 4; BDBM20294 ...
MW:     506.629903 g/mol MF: C26H35FN2O5S
IUPAC name: [2-[(3,4-dimethylphenyl)methyl]-3-[[2-[3-fluoro-4-(methanesu...
Create Date: 2008-04-23
CID: 24768193

912. CHEMBL72104; amide analogue, 3; BDBM20288
MW:     534.683063 g/mol MF: C28H39FN2O5S
IUPAC name: [2-[(4-tert-butylphenyl)methyl]-3-[[2-[3-fluoro-4-(methanesu...
Create Date: 2008-04-23
CID: 24768192

913. ketone analog, 3m; CHEMBL232911; SCHEMBL14405157 ...
MW:     577.613513 g/mol MF: C29H35F4N5O3
IUPAC name: [(2S)-3,3-dimethyl-1-[3-[4-(trifluoromethyl)phenyl]pyrazol-1...
Create Date: 2008-01-19
CID: 23648440

914. ketone analog, 3l; CHEMBL394698; SCHEMBL14405160 ...
MW:     595.653610 g/mol MF: C29H40F3N5O5
IUPAC name: [(2S)-3,3-dimethyl-1-[3-[4-(trifluoromethyl)phenyl]pyrazol-1...
Create Date: 2008-01-19
CID: 23648439

915. ketone analog, 3k; CHEMBL232713; SCHEMBL14384156 ...
MW:     598.541720 g/mol MF: C26H33Cl2N5O5S
IUPAC name: [(2S)-1-(5,6-dichlorobenzimidazol-1-yl)-3,3-dimethylbutan-2-...
Create Date: 2008-01-19
CID: 23648438

916. ketone analog, 3j; CHEMBL232712; SCHEMBL14384160 ...
MW:     556.461980 g/mol MF: C23H27Cl2N5O5S
IUPAC name: [(2S)-1-(5,6-dichlorobenzimidazol-1-yl)-3,3-dimethylbutan-2-...
Create Date: 2008-01-19
CID: 23648437

917. ketone analog, 3i; CHEMBL232520; SCHEMBL14384154 ...
MW:     556.676940 g/mol MF: C27H36N6O5S
IUPAC name: [(2S)-3,3-dimethyl-1-(3-pyridin-3-ylpyrazol-1-yl)butan-2-yl]...
Create Date: 2008-01-19
CID: 23648436

918. ketone analog, 3g; CHEMBL393673; BDBM19790 ...
MW:     623.686850 g/mol MF: C29H36F3N5O5S
IUPAC name: [(2S)-3,3-dimethyl-1-[4-[4-(trifluoromethyl)phenyl]pyrazol-1...
Create Date: 2008-01-19
CID: 23648435

919. ketone analog, 3f; CHEMBL233706; SCHEMBL14405182 ...
MW:     623.686850 g/mol MF: C29H36F3N5O5S
IUPAC name: [(2S)-3,3-dimethyl-1-[4-[4-(trifluoromethyl)phenyl]imidazol-...
Create Date: 2008-01-19
CID: 23648434

920. ketone analog, 3e; CHEMBL232518; SCHEMBL14405051 ...
MW:     547.590890 g/mol MF: C23H32F3N5O5S
IUPAC name: [(2S)-3,3-dimethyl-1-[3-(trifluoromethyl)pyrazol-1-yl]butan-...
Create Date: 2008-01-19
CID: 23648433

921. ketone analog, 3d; CHEMBL234576; SCHEMBL14405127 ...
MW:     505.511150 g/mol MF: C20H26F3N5O5S
IUPAC name: [(2S)-3,3-dimethyl-1-[3-(trifluoromethyl)pyrazol-1-yl]butan-...
Create Date: 2008-01-19
CID: 23648432

922. ketone analog, 3c; CHEMBL203463; SCHEMBL14405178 ...
MW:     623.686850 g/mol MF: C29H36F3N5O5S
IUPAC name: [(2S)-3,3-dimethyl-1-[3-[4-(trifluoromethyl)phenyl]pyrazol-1...
Create Date: 2008-01-19
CID: 23648431

923. ketone analog, 3b; CHEMBL540964; BDBM19785 ...
MW:     581.607110 g/mol MF: C26H30F3N5O5S
IUPAC name: [(2S)-3,3-dimethyl-1-[3-[4-(trifluoromethyl)phenyl]pyrazol-1...
Create Date: 2008-01-19
CID: 23648430

924. ketone analog, 3a; CHEMBL234368; SCHEMBL5631783 ...
MW:     567.580530 g/mol MF: C25H28F3N5O5S
IUPAC name: [(2S)-3,3-dimethyl-1-[3-[4-(trifluoromethyl)phenyl]pyrazol-1...
Create Date: 2008-01-19
CID: 23648429

925. pyrrole analog 4b; CHEMBL193340; BDBM14451 ...
MW:     432.473300 g/mol MF: C27H20N4O2
IUPAC name: 1-[[3-(1,3-benzodioxol-5-ylmethyl)imidazol-4-yl]methyl]-4-na...
Create Date: 2008-01-19
CID: 23646777

926. pyrrole analog 4a; CHEMBL380554; BDBM14450 ...
MW:     413.473260 g/mol MF: C27H19N5
IUPAC name: 1-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]-4-naphtha...
Create Date: 2008-01-19
CID: 23646776

927. indole analog 17b; BDBM14431; (4-chlorophenyl)(1-methyl-1H-imidazol-5-yl)[1-(naphthalen-1-yl)-1H-indol-6-yl]methanol
MW:     463.957480 g/mol MF: C29H22ClN3O
IUPAC name: (4-chlorophenyl)-(3-methylimidazol-4-yl)-(1-naphthalen-1-yli...
Create Date: 2008-01-19
CID: 23646760

928. indole analog 17a; BDBM14430; (4-chlorophenyl)[1-(3-chlorophenyl)-1H-indol-6-yl](1-methyl-1H-imidazol-5-yl)methanol
MW:     448.343860 g/mol MF: C25H19Cl2N3O
IUPAC name: (4-chlorophenyl)-[1-(3-chlorophenyl)indol-6-yl]-(3-methylimi...
Create Date: 2008-01-19
CID: 23646759

929. pyrazole analog 8f; CHEMBL184887; BDBM12773 ...
MW:     532.983040 g/mol MF: C29H21ClN8O
IUPAC name: 2-(3-carbamimidoylphenyl)-N-[4-(5-chlorobenzimidazol-1-yl)ph...
Create Date: 2008-01-19
CID: 23646207

930. pyrazole analog 8e; CHEMBL183002; BDBM12772 ...
MW:     498.537980 g/mol MF: C29H22N8O
IUPAC name: N-[4-(benzimidazol-1-yl)phenyl]-2-(3-carbamimidoylphenyl)-5-...
Create Date: 2008-01-19
CID: 23646206

931. pyrazole analog 8d; CHEMBL187097; BDBM12771 ...
MW:     503.518040 g/mol MF: C26H21N11O
IUPAC name: N-[4-(benzimidazol-1-yl)phenyl]-2-(3-carbamimidoylphenyl)-5-...
Create Date: 2008-01-19
CID: 23646205

932. pyrazole analog 8c; CHEMBL185232; BDBM12770 ...
MW:     502.529980 g/mol MF: C27H22N10O
IUPAC name: N-[4-(benzimidazol-1-yl)phenyl]-2-(3-carbamimidoylphenyl)-5-...
Create Date: 2008-01-19
CID: 23646204

933. pyrazole analog 8b; BDBM12769; N-[4-(1H-1,3-benzodiazol-1-yl)phenyl]-1-(3-carbamimidoylphenyl)-3-(3-methyl-1H-1,2,4-triazol-1-yl)-1H-pyrazole-5-carboxamide
MW:     502.529980 g/mol MF: C27H22N10O
IUPAC name: N-[4-(benzimidazol-1-yl)phenyl]-2-(3-carbamimidoylphenyl)-5-...
Create Date: 2008-01-19
CID: 23646203

934. pyrazole analog 8a; CHEMBL426071; BDBM12768 ...
MW:     501.541920 g/mol MF: C28H23N9O
IUPAC name: N-[4-(benzimidazol-1-yl)phenyl]-2-(3-carbamimidoylphenyl)-5-...
Create Date: 2008-01-19
CID: 23646202

935. pyrazole analog 3n; CHEMBL186272; BDBM12765 ...
MW:     506.454333 g/mol MF: C26H18F4N6O
IUPAC name: 2-(3-carbamimidoylphenyl)-N-(2-fluoro-4-indol-1-ylphenyl)-5-...
Create Date: 2008-01-19
CID: 23646200

936. pyrazole analog 3m; CHEMBL360636; BDBM12764 ...
MW:     576.332513 g/mol MF: C25H15Cl2F4N7O
IUPAC name: 2-(3-carbamimidoylphenyl)-N-[4-(5,6-dichlorobenzimidazol-1-y...
Create Date: 2008-01-19
CID: 23646199

937. pyrazole analog 3l; CHEMBL434521; BDBM12763 ...
MW:     552.439953 g/mol MF: C25H16F4N8O3
IUPAC name: 2-(3-carbamimidoylphenyl)-N-[2-fluoro-4-(5-nitrobenzimidazol...
Create Date: 2008-01-19
CID: 23646198

938. pyrazole analog 3k; CHEMBL363962; BDBM12762 ...
MW:     522.457033 g/mol MF: C25H18F4N8O
IUPAC name: N-[4-(5-aminobenzimidazol-1-yl)-2-fluorophenyl]-2-(3-carbami...
Create Date: 2008-01-19
CID: 23646197

939. pyrazole analog 3j; CHEMBL186693; BDBM12761 ...
MW:     521.468973 g/mol MF: C26H19F4N7O
IUPAC name: 2-(3-carbamimidoylphenyl)-N-[2-fluoro-4-(5-methylbenzimidazo...
Create Date: 2008-01-19
CID: 23646196

940. pyrazole analog 3i; CHEMBL184427; BDBM12760 ...
MW:     575.440362 g/mol MF: C26H16F7N7O
IUPAC name: 2-(3-carbamimidoylphenyl)-N-[2-fluoro-4-[5-(trifluoromethyl)...
Create Date: 2008-01-19
CID: 23646195

941. pyrazole analog 3h; CHEMBL425538; BDBM12759 ...
MW:     541.887453 g/mol MF: C25H16ClF4N7O
IUPAC name: 2-(3-carbamimidoylphenyl)-N-[4-(6-chlorobenzimidazol-1-yl)-2...
Create Date: 2008-01-19
CID: 23646194

942. pyrazole analog 3g; CHEMBL186761; BDBM12758 ...
MW:     541.887453 g/mol MF: C25H16ClF4N7O
IUPAC name: 2-(3-carbamimidoylphenyl)-N-[4-(5-chlorobenzimidazol-1-yl)-2...
Create Date: 2008-01-19
CID: 23646193

943. pyrazole analog 3f; CHEMBL183785; BDBM12757 ...
MW:     508.430453 g/mol MF: C24H16F4N8O
IUPAC name: 2-(3-carbamimidoylphenyl)-N-(2-fluoro-4-imidazo[4,5-b]pyridi...
Create Date: 2008-01-19
CID: 23646192

944. pyrazole analog 3e; CHEMBL362362; BDBM12756 ...
MW:     508.430453 g/mol MF: C24H16F4N8O
IUPAC name: 2-(3-carbamimidoylphenyl)-N-(2-fluoro-4-imidazo[4,5-c]pyridi...
Create Date: 2008-01-19
CID: 23646191

945. pyrazole analog 3d; CHEMBL426439; BDBM12755 ...
MW:     508.430453 g/mol MF: C24H16F4N8O
IUPAC name: 2-(3-carbamimidoylphenyl)-N-(2-fluoro-4-imidazo[4,5-c]pyridi...
Create Date: 2008-01-19
CID: 23646190

946. pyrazole analog 3c; CHEMBL185301; BDBM12754 ...
MW:     508.430453 g/mol MF: C24H16F4N8O
IUPAC name: 2-(3-carbamimidoylphenyl)-N-(2-fluoro-4-imidazo[4,5-b]pyridi...
Create Date: 2008-01-19
CID: 23646189

947. pyrazole analog 3a; CHEMBL186831; BDBM12752 ...
MW:     489.451930 g/mol MF: C25H18F3N7O
IUPAC name: N-[4-(benzimidazol-1-yl)phenyl]-2-(3-carbamimidoylphenyl)-5-...
Create Date: 2008-01-19
CID: 23646188

948. pyrazole analog 1; CHEMBL366323; SCHEMBL3830470 ...
MW:     435.480540 g/mol MF: C25H21N7O
IUPAC name: N-[4-(benzimidazol-1-yl)phenyl]-2-(3-carbamimidoylphenyl)-5-...
Create Date: 2008-01-19
CID: 23644671

949. pyrazole analog 3p; CHEMBL185707; SCHEMBL3829912 ...
MW:     439.393250 g/mol MF: C21H16F3N7O
IUPAC name: 2-(3-carbamimidoylphenyl)-N-(4-imidazol-1-ylphenyl)-5-(trifl...
Create Date: 2007-12-04
CID: 18549509

950. ketone analog, 3h; CHEMBL393354; SCHEMBL14384155 ...
MW:     556.676940 g/mol MF: C27H36N6O5S
IUPAC name: [(2S)-3,3-dimethyl-1-(3-pyridin-4-ylpyrazol-1-yl)butan-2-yl]...
Create Date: 2007-08-09
CID: 16655063

951. CAAX Analogue 9; CHEMBL204384; BDBM13366 ...
MW:     528.685140 g/mol MF: C23H36N4O6S2
IUPAC name: (2S)-2-[[(2R)-2-[[(2S)-2-[[(2R)-2-amino-3-sulfanylpropanoyl]...
Create Date: 2006-10-26
CID: 11685143

952. CAAX Analogue 3; CHEMBL436948; BDBM13360 ...
MW:     526.712320 g/mol MF: C24H38N4O5S2
IUPAC name: (2S)-2-[[(2R)-2-[[(2S)-2-[[(2R)-2-amino-3-sulfanylpropanoyl]...
Create Date: 2006-10-26
CID: 11678115

953. CAAX Analogue 5; CHEMBL446184; BDBM13362 ...
MW:     542.711720 g/mol MF: C24H38N4O6S2
IUPAC name: (2S)-2-[[(2R)-2-[[(2S)-2-[[(2R)-2-amino-3-sulfanylpropanoyl]...
Create Date: 2006-10-26
CID: 11671111

954. CAAX Analogue 7; CHEMBL203750; BDBM13364 ...
MW:     542.711720 g/mol MF: C24H38N4O6S2
IUPAC name: (2S)-2-[[(2R)-2-[[(2S)-2-[[(2R)-2-amino-3-sulfanylpropanoyl]...
Create Date: 2006-10-26
CID: 11663899

955. CAAX Analogue 2; CHEMBL382870; BDBM13359 ...
MW:     526.712320 g/mol MF: C24H38N4O5S2
IUPAC name: (2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-amino-3-sulfanylpropanoyl]...
Create Date: 2006-10-26
CID: 11606166

956. CAAX Analogue 6; CHEMBL204071; BDBM13363 ...
MW:     542.711720 g/mol MF: C24H38N4O6S2
IUPAC name: (2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-amino-3-sulfanylpropanoyl]...
Create Date: 2006-10-26
CID: 11591983

957. CAAX Analogue 8; CHEMBL380529; BDBM13365 ...
MW:     528.685140 g/mol MF: C23H36N4O6S2
IUPAC name: (2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-amino-3-sulfanylpropanoyl]...
Create Date: 2006-10-26
CID: 11584551

958. CAAX Analogue 4; CHEMBL203758; BDBM13361 ...
MW:     542.711720 g/mol MF: C24H38N4O6S2
IUPAC name: (2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-amino-3-sulfanylpropanoyl]...
Create Date: 2006-10-26
CID: 11577483

959. CAAX Analogue 1; CHEMBL206754; BDBM13358 ...
MW:     502.690920 g/mol MF: C22H38N4O5S2
IUPAC name: (2S)-2-[[(2R)-1-[(2S)-2-[[(2R)-2-amino-3-sulfanylpropanoyl]a...
Create Date: 2006-10-26
CID: 11569637

960. CHEMBL126545; Imide Analog 15; BDBM14188 ...
MW:     342.370600 g/mol MF: C20H10N2O2S
Create Date: 2006-10-26
CID: 11067837

961. GP-L AnaloGue; SCHEMBL8359382; W-2744 ...
MW:     308.349483 g/mol MF: C19H17FN2O
IUPAC name: 2-benzyl-8-fluoro-1,3,4,5-tetrahydrobenzo[c][1,6]naphthyridi...
Create Date: 2006-10-25
CID: 9857783

962. CHEMBL332575; Imide Analog 12; BDBM14187 ...
MW:     336.342880 g/mol MF: C22H12N2O2
Create Date: 2006-10-25
CID: 9797847

963. KMI-008; CHEMBL406146; Octapeptide analogue ...
MW:     999.070940 g/mol MF: C47H66N8O16
IUPAC name: (4S)-4-amino-5-[[(2S)-1-[[(2S)-1-[[(2S,3R)-4-[[(2S)-3-carbox...
Create Date: 2006-07-28
CID: 6918718

964. Creatinine acetic acid analogue 20; AC1O6ZYI; BDBM8455 ...
MW:     345.737180 g/mol MF: C16H12ClN3O4
IUPAC name: [(5E)-5-[[5-(4-chlorophenyl)furan-2-yl]methylidene]-1-methyl...
Create Date: 2006-05-10
CID: 6539645

965. Caryoynencin analog; AC1O6FLG; E- & Z-Tetradeca-3,5-dien-7,9,11,13-tetrayn-2-ol ...
MW:     388.457200 g/mol MF: C28H20O2
IUPAC name: (3E,5Z)-tetradeca-3,5-dien-7,9,11,13-tetrayn-2-ol;(3E,5E)-te...
Create Date: 2006-04-29
CID: 6474959

966. MRNA CAP ANALOG N7-METHYL GPPPG; AC1O3S7R; DB03958 ...
MW:     803.440386 g/mol MF: C21H30N10O18P3+
IUPAC name: [[(2S,3R,4R,5R)-5-(2-amino-7-methyl-6-oxo-3H-purin-9-ium-9-y...
Create Date: 2005-08-08
CID: 6335949

967. 1,2,4-Oxadiazole Analogue 14f; AC1O3EHU; BDBM5091 ...
MW:     671.560232 g/mol MF: C31H29F3N5O7P
IUPAC name: [4-[(2S)-2-[[2-(1H-indol-3-yl)acetyl]amino]-3-oxo-3-[[(1S)-1...
Create Date: 2006-01-30
CID: 6326463

968. 1,2,4-Oxadiazole Analogue 14d; AC1O3EHR; BDBM5089 ...
MW:     662.550172 g/mol MF: C30H30F3N4O8P
IUPAC name: [4-[(2S)-2-[[2-(4-methoxyphenyl)acetyl]amino]-3-oxo-3-[[(1S)...
Create Date: 2006-01-30
CID: 6326462

969. 1,2,4-Oxadiazole Analogue 14c; AC1O3EHO; BDBM5088 ...
MW:     668.505118 g/mol MF: C29H26F5N4O7P
IUPAC name: [4-[(2S)-2-[[2-(3,4-difluorophenyl)acetyl]amino]-3-oxo-3-[[(...
Create Date: 2006-01-30
CID: 6326461

970. 1,2,4-Oxadiazole Analogue 14a; AC1O3EHL; BDBM5086 ...
MW:     632.524192 g/mol MF: C29H28F3N4O7P
IUPAC name: [4-[(2S)-3-oxo-2-[(2-phenylacetyl)amino]-3-[[(1S)-1-[3-[[4-(...
Create Date: 2006-01-30
CID: 6326460

971. L-682, 679 analog 31; AC1O3EDC; CHEMBL97299 ...
MW:     659.854620 g/mol MF: C39H53N3O6
IUPAC name: tert-butyl N-[(2S,3S,5R)-5-benzyl-3-hydroxy-6-[[(2S)-1-[(1-h...
Create Date: 2006-01-30
CID: 6326399

972. Paullone Analog 3; NSC709125; AC1NSACM ...
MW:     353.328800 g/mol MF: C18H15N3O5
IUPAC name: 2,3-dimethoxy-9-nitro-7,12-dihydro-5H-indolo[3,2-d][1]benzaz...
Create Date: 2005-03-26
CID: 5331104

973. 1,2,4-Oxadiazole Analogue 15c; AC1NS6C2; BDBM5106 ...
MW:     630.584302 g/mol MF: C32H31N4O8P
IUPAC name: [4-[(2S)-3-[[(1S)-2-hydroxy-1-[3-(naphthalen-2-ylmethyl)-1,2...
Create Date: 2006-01-30
CID: 5329228

974. 1,2,4-Oxadiazole Analogue 15b; AC1NS6C0; BDBM5105 ...
MW:     649.415742 g/mol MF: C28H27Cl2N4O8P
IUPAC name: [4-[(2S)-3-[[(1S)-1-[3-[(3,4-dichlorophenyl)methyl]-1,2,4-ox...
Create Date: 2006-01-30
CID: 5329227

975. 1,2,4-Oxadiazole Analogue 15a; AC1NS6BX; BDBM5104 ...
MW:     648.523592 g/mol MF: C29H28F3N4O8P
IUPAC name: [4-[(2S)-3-[[(1S)-2-hydroxy-1-[3-[[4-(trifluoromethyl)phenyl...
Create Date: 2006-01-30
CID: 5329226

976. 1,2,4-Oxadiazole Analogue 13c; AC1NS6BU; BDBM5103 ...
MW:     647.442922 g/mol MF: C29H29Cl2N4O7P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-1-[3-[(3,4-dichlorophenyl)meth...
Create Date: 2006-01-30
CID: 5329225

977. 1,2,4-Oxadiazole Analogue 13b; AC1NS6BR; BDBM5102 ...
MW:     628.611482 g/mol MF: C33H33N4O7P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-1-[3-(naphthalen-2-ylmethyl)-1...
Create Date: 2006-01-30
CID: 5329224

978. 1,2,4-Oxadiazole Analogue 13a; AC1NS6BO; BDBM5101 ...
MW:     646.550772 g/mol MF: C30H30F3N4O7P
IUPAC name: [4-[(2S)-2-acetamido-3-oxo-3-[[(1S)-3-phenyl-1-[3-[[4-(trifl...
Create Date: 2006-01-30
CID: 5329223

979. 1,2,4-Oxadiazole Analogue 12d; AC1NS6BL; BDBM5100 ...
MW:     572.427632 g/mol MF: C23H24F3N4O8P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-2-hydroxy-1-[3-[[4-(trifluorom...
Create Date: 2006-01-30
CID: 5329222

980. 1,2,4-Oxadiazole Analogue 12c; AC1NS6BI; BDBM5099 ...
MW:     554.488342 g/mol MF: C26H27N4O8P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-2-hydroxy-1-[3-(naphthalen-2-y...
Create Date: 2006-01-30
CID: 5329221

981. CHEMBL316967; 1,2,4-Oxadiazole Analogue 12b; AC1NS6BF ...
MW:     573.319782 g/mol MF: C22H23Cl2N4O8P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-1-[3-[(3,4-dichlorophenyl)meth...
Create Date: 2006-01-30
CID: 5329220

982. 1,2,4-Oxadiazole Analogue 14e; AC1NS6AX; BDBM5090 ...
MW:     682.582872 g/mol MF: C33H30F3N4O7P
IUPAC name: [4-[(2S)-2-[(2-naphthalen-2-ylacetyl)amino]-3-oxo-3-[[(1S)-1...
Create Date: 2006-01-30
CID: 5329212

983. 1,2,4-Oxadiazole Analogue 14b; AC1NS6AU; BDBM5087 ...
MW:     638.551912 g/mol MF: C27H26F3N4O7PS
IUPAC name: [4-[(2S)-3-oxo-2-[(2-thiophen-2-ylacetyl)amino]-3-[[(1S)-1-[...
Create Date: 2006-01-30
CID: 5329209

984. 1,2,4-Oxadiazole Analogue 12g; AC1NS6AR; BDBM5085 ...
MW:     630.326192 g/mol MF: C22H24IN4O8P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-2-hydroxy-1-[3-[(4-iodophenyl)...
Create Date: 2006-01-30
CID: 5329207

985. 1,2,4-Oxadiazole Analogue 12f; AC1NS6AO; BDBM5084 ...
MW:     583.325722 g/mol MF: C22H24BrN4O8P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-1-[3-[(4-bromophenyl)methyl]-1...
Create Date: 2006-01-30
CID: 5329206

986. 1,2,4-Oxadiazole Analogue 12e; AC1NS6AL; BDBM5083 ...
MW:     522.420125 g/mol MF: C22H24FN4O8P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-1-[3-[(4-fluorophenyl)methyl]-...
Create Date: 2006-01-30
CID: 5329205

987. 1,2,4-Oxadiazole Analogue 12a; AC1NS6AI; BDBM5082 ...
MW:     538.874722 g/mol MF: C22H24ClN4O8P
IUPAC name: [4-[(2S)-2-acetamido-3-[[(1S)-1-[3-[(4-chlorophenyl)methyl]-...
Create Date: 2006-01-30
CID: 5329204

988. 1-{3-[AMINO(IMINO)METHYL]PHENYL}-N-[4-(1H-BENZIMIDAZOL-1-YL)-2-FLUOROPHENYL]-3-(TRIFLUOROMETHYL)-1H-PYRAZOLE-5-CARBOXAMIDE; pyrazole analog 3b; 1x7a ...
MW:     507.442393 g/mol MF: C25H17F4N7O
IUPAC name: N-[4-(benzimidazol-1-yl)-2-fluorophenyl]-2-(3-carbamimidoylp...
Create Date: 2005-11-29
CID: 5287439

989. alsterpaullone; 9-Nitropaullone; 237430-03-4 ...
MW:     293.276840 g/mol MF: C16H11N3O3
IUPAC name: 9-nitro-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-one
Create Date: 2005-03-25
CID: 5005498

990. Fentanyl 1-para methylphenyl analog; AC1LDHKG; SCHEMBL9917098 ...
MW:     350.497100 g/mol MF: C23H30N2O
IUPAC name: N-[1-[2-(4-methylphenyl)ethyl]piperidin-4-yl]-N-phenylpropan...
Create Date: 2005-03-27
CID: 618628

991. Analog of PMEG; AC1LAQPS; SCHEMBL6401935 ...
MW:     281.226042 g/mol MF: C7H12N3O5PS
IUPAC name: 2-[(2-amino-6-oxo-1H-pyrimidin-4-yl)sulfanyl]ethoxymethylpho...
Create Date: 2005-08-01
CID: 493371

992. CHEMBL2370476; Ac-D-D-I-V-P-C-OH; Hexapeptide analogue ...
MW:     702.773540 g/mol MF: C29H46N6O12S
IUPAC name: (3S)-3-acetamido-4-[[(2R)-3-carboxy-1-[[(2S,3S)-1-[[(2S)-1-[...
Create Date: 2005-08-01
CID: 483692

993. AZT/PFA analog; AC1L9ST4; Methyl, 3'-azido-2',3'-dideoxythymidine-5'-(methoxyphosphoryl)formate ...
MW:     419.350082 g/mol MF: C13H18N5O7PS
IUPAC name: methyl [[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1...
Create Date: 2005-08-01
CID: 475370

994. AZT/TPFA analog; [(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl 2-(2-naphthyloxy)ethyl hydrogen phosphate; AC1LACD3 ...
MW:     517.428422 g/mol MF: C22H24N5O8P
IUPAC name: [(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxol...
Create Date: 2005-08-01
CID: 465802

995. Pneumocandin analog; AC1LA677; L-733,560 ...
MW:    1094.297880 g/mol MF: C52H87N9O16
Create Date: 2005-08-01
CID: 462495

996. 1H-Benzimidazole-6-carboximidamide,2,2'-(1,4-butanediyl)bis-; 100562-53-6; Pentadiamine analog ...
MW:     374.442280 g/mol MF: C20H22N8
IUPAC name: 2-[4-(6-carbamimidoyl-1H-benzimidazol-2-yl)butyl]-3H-benzimi...
Create Date: 2005-08-01
CID: 456211

997. (1R,2R,4aS)-1,2-dihydroxy-2,4a,5,11b-tetrahydro-1H-[1,3]dioxolo[4,5-j]phenanthridin-6-one; Lycoridicine analog; AC1L9RHU ...
MW:     275.256720 g/mol MF: C14H13NO5
IUPAC name: (1R,2R,4aS)-1,2-dihydroxy-2,4a,5,11b-tetrahydro-1H-[1,3]diox...
Create Date: 2005-08-01
CID: 454230

998. 132198-20-0; 2(1H)-Pyrimidinone, 4-amino-1-(3,6-dihydro-6-(hydroxymethyl)-2H-pyran-2-yl)-, (2R-cis)-; 4-amino-1-[(2R,6S)-6-(hydroxymethyl)-3,6-dihydro-2H-pyran-2-yl]pyrimidin-2-one ...
MW:     223.228520 g/mol MF: C10H13N3O3
IUPAC name: 4-amino-1-[(2R,6S)-6-(hydroxymethyl)-3,6-dihydro-2H-pyran-2-...
Create Date: 2005-08-01
CID: 453157

999. 1-(Methoxy-(4-hydroxybuten-3-yl)-cytosine; 1-(METHOXY-(4-HYDROXYBUTEN-3-YL)CYTOSINE; 136083-20-0 ...
MW:     211.217820 g/mol MF: C9H13N3O3
IUPAC name: 4-amino-1-[[(2S)-1-hydroxybut-3-en-2-yl]oxymethyl]pyrimidin-...
Create Date: 2005-08-01
CID: 452998

1000. Paullone Analog 4; NSC708244; AC1L9GN6 ...
MW:     333.340700 g/mol MF: C19H15N3O3
IUPAC name: 2,3-dimethoxy-6-oxo-7,12-dihydro-5H-indolo[3,2-d][1]benzazep...
Create Date: 2005-03-26
CID: 398465

1001. 9-Cyanopaullone; CHEMBL299756; 6-oxo-7,12-dihydro-5H-indolo[3,2-d][1]benzazepine-9-carbonitrile ...
MW:     273.288740 g/mol MF: C17H11N3O
IUPAC name: 6-oxo-7,12-dihydro-5H-indolo[3,2-d][1]benzazepine-9-carbonit...
Create Date: 2005-03-26
CID: 397216

1002. CHEMBL328194; Paullone Analog 9; NSC702378 ...
MW:     376.329210 g/mol MF: C19H15F3N2O3
IUPAC name: 2,3-dimethoxy-9-(trifluoromethyl)-7,12-dihydro-5H-indolo[3,2...
Create Date: 2005-03-26
CID: 396412

1003. CHEMBL329505; Paullone Analog 7; NSC701590 ...
MW:     316.277250 g/mol MF: C17H11F3N2O
IUPAC name: 9-(trifluoromethyl)-7,12-dihydro-5H-indolo[3,2-d][1]benzazep...
Create Date: 2005-03-26
CID: 396079

1004. NSC672232; CHEMBL98153; 9-Chloro-7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one ...
MW:     282.724340 g/mol MF: C16H11ClN2O
IUPAC name: 9-chloro-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-one
Create Date: 2005-03-26
CID: 383785

1005. Dialifor oxon; Phosphorothioic acid, S-(2-chloro-1-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl) O,O-diethyl ester; torac oxygen analog ...
MW:     377.780242 g/mol MF: C14H17ClNO5PS
IUPAC name: 2-(2-chloro-1-diethoxyphosphorylsulfanylethyl)isoindole-1,3-...
Create Date: 2005-08-08
CID: 167745

1006. 7-METHYL-GUANOSINE-5'-TRIPHOSPHATE-5'-GUANOSINE; MRNA CAP ANALOG N7-METHYL GPPPG; 1h2u ...
MW:     803.440386 g/mol MF: C21H30N10O18P3+
IUPAC name: [[(2R,3S,4R,5R)-5-(2-amino-7-methyl-6-oxo-3H-purin-9-ium-9-y...
Create Date: 2005-06-24
CID: 121959

1007. Erythromyclamine; Erythromycylamine; Erythromycin, 9-amino-9-deoxo- ...
MW:     734.957900 g/mol MF: C37H70N2O12
IUPAC name: (3R,4S,5S,6R,7R,9R,11S,12R,13S,14R)-10-amino-6-[(2S,3R,4S,6R...
Create Date: 2005-08-01
CID: 83942

1008. Fenoxon; Fenthion oxon; Bayoxon ...
MW:     262.262462 g/mol MF: C10H15O4PS
IUPAC name: dimethyl (3-methyl-4-methylsulfanylphenyl) phosphate
Create Date: 2005-03-27
CID: 23046

1009. kenpaullone; 142273-20-9; NSC 664704 ...
MW:     327.175340 g/mol MF: C16H11BrN2O
IUPAC name: 9-bromo-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-one
Create Date: 2005-03-25
CID: 3820

1010. (9s)-n-(l-alanyl)-4,9-diamino-6,10-dimethyl-2-(3-methylbutanoyl)-n-(3-methylbutyl)-3,8-dioxoundecanamide; Pepstatin ketone analog; AC1Q5BDQ ...
MW:     496.683120 g/mol MF: C26H48N4O5
IUPAC name: (9S)-4,9-diamino-N-[(2S)-2-aminopropanoyl]-6,10-dimethyl-2-(...
Create Date: 2005-08-08
CID: 133694

1011. TLM analog, 1; BDBM50241313; (5R)-4-hydroxy-3,5-dimethyl-5-[(1E)-2-methylbuta-1,3-dienyl]thiophen-2(5H)-one ...
MW:     210.292660 g/mol MF: C11H14O2S
IUPAC name: (5R)-3,5-dimethyl-5-[(1E)-2-methylbuta-1,3-dienyl]thiolane-2...
Create Date: 2015-10-14
CID: 91935543

1012. TLM analog, 2; BDBM93045
MW:     196.266080 g/mol MF: C10H12O2S
IUPAC name: (5R)-5-methyl-5-[(1E)-2-methylbuta-1,3-dienyl]thiolane-2,4-d...
Create Date: 2015-10-07
CID: 91899470

1013. cyclohexene analog 8; BDBM12651; (1S,6R)-3-[(4-carboxypiperidin-1-yl)methyl]-6-(2,4-dichlorophenyl)cyclohex-3-en-1-aminium; 2,2,2-trifluoroacetate ...
MW:     384.320000 g/mol MF: C19H25Cl2N2O2+
IUPAC name: [(1S,6R)-3-[(4-carboxypiperidin-1-yl)methyl]-6-(2,4-dichloro...
Create Date: 2015-10-06
CID: 91895871

1014. cyclohexene analog 7; BDBM12650; trans-6-(2-Chlorophenyl)-3-phenylcyclohex-3-en-1-amine.TFA ...
MW:     284.803160 g/mol MF: C18H19ClN+
IUPAC name: [(1S,6R)-6-(2-chlorophenyl)-3-phenylcyclohex-3-en-1-yl]azani...
Create Date: 2015-10-06
CID: 91895870

1015. TLM analog, 9; BDBM93052
MW:     434.674880 g/mol MF: C26H42O3S
IUPAC name: (5R)-3-hexadecanoyl-5-methyl-5-[(1E)-2-methylbuta-1,3-dienyl...
Create Date: 2013-06-10
CID: 71469115

1016. TLM analog, 7; BDBM93050
MW:     266.355920 g/mol MF: C14H18O3S
IUPAC name: (5R)-3-butanoyl-5-methyl-5-[(1E)-2-methylbuta-1,3-dienyl]thi...
Create Date: 2013-06-10
CID: 71469112

1017. TLM analog, 8; BDBM93051
MW:     254.302160 g/mol MF: C12H14O4S
IUPAC name: methyl (5R)-5-methyl-5-[(1E)-2-methylbuta-1,3-dienyl]-2,4-di...
Create Date: 2013-06-10
CID: 71469111

1018. TLM analog, 6; BDBM93049
MW:     292.274150 g/mol MF: C12H11F3O3S
IUPAC name: (5R)-5-methyl-5-[(1E)-2-methylbuta-1,3-dienyl]-3-(2,2,2-trif...
Create Date: 2013-06-10
CID: 71469110

1019. TLM analog, 5; BDBM93048
MW:     238.302760 g/mol MF: C12H14O3S
IUPAC name: (5R)-3-acetyl-5-methyl-5-[(1E)-2-methylbuta-1,3-dienyl]thiol...
Create Date: 2013-06-10
CID: 71469109

1020. TLM analog, 4; BDBM93047
MW:     238.345820 g/mol MF: C13H18O2S
IUPAC name: (5R)-5-methyl-5-[(1E)-2-methylbuta-1,3-dienyl]-3-propylthiol...
Create Date: 2013-06-10
CID: 71468874

1021. TLM analog, 3; BDBM93046
MW:     224.319240 g/mol MF: C12H16O2S
IUPAC name: (5R)-3-ethyl-5-methyl-5-[(1E)-2-methylbuta-1,3-dienyl]thiola...
Create Date: 2013-06-10
CID: 71468873

1022. 1-68Ad analogue; BDBM92938
MW:     395.320880 g/mol MF: C16H17N3O9
IUPAC name: 1-[5-[[(3,5-dihydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)meth...
Create Date: 2013-05-31
CID: 71463388

1023. 1-68Ac analogue; BDBM92937
MW:     379.321480 g/mol MF: C16H17N3O8
IUPAC name: 1-[3,4-dihydroxy-5-[[[(Z)-(5-hydroxy-6-oxocyclohexa-2,4-dien...
Create Date: 2013-05-31
CID: 71463387

1024. 1-68Aa analogue; BDBM92936
MW:     379.321480 g/mol MF: C16H17N3O8
IUPAC name: 1-[3,4-dihydroxy-5-[[[(Z)-(3-hydroxy-4-oxocyclohexa-2,5-dien...
Create Date: 2013-05-31
CID: 71463386

1025. 2-68A analogue; BDBM92935
MW:     452.372200 g/mol MF: C18H20N4O10
IUPAC name: 2-[[(E)-(2,3-dihydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)met...
Create Date: 2013-05-31
CID: 71463385

1026. 1-68A analogue; BDBM92934
MW:     395.320880 g/mol MF: C16H17N3O9
IUPAC name: 1-[5-[[[(Z)-(2,3-dihydroxy-4-oxocyclohexa-2,5-dien-1-ylidene...
Create Date: 2013-05-31
CID: 71463384

1027. RY Analogue, 9; BDBM92369
MW:     390.479900 g/mol MF: C19H30N6O3
IUPAC name: (2S)-2-acetamido-5-(diaminomethylideneamino)-N-[(2S)-1-(ethy...
Create Date: 2013-02-27
CID: 70701970

1028. RY Analogue, 8; BDBM92368
MW:     406.479300 g/mol MF: C19H30N6O4
IUPAC name: (2S)-2-acetamido-5-(diaminomethylideneamino)-N-[(2S)-1-(ethy...
Create Date: 2013-02-27
CID: 70701969

1029. Chalcone analog, 1; BDBM91639
MW:     312.273580 g/mol MF: C17H12O6
IUPAC name: [2-formyloxy-4-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]phe...
Create Date: 2012-07-07
CID: 57340889

1030. Cyclic analogue, 9; BDBM84503; 2-Methoxy-3,23-epinitrilo-5,8-epimino-18,22-methenocyclotricosa-1,3,5,7,13,18,20-heptaene
MW:     372.502620 g/mol MF: C25H28N2O
Create Date: 2012-07-07
CID: 57339724

1031. Cyclic analogue, 8; BDBM84502
MW:     460.650800 g/mol MF: C30H40N2O2
Create Date: 2012-07-07
CID: 57339723

1032. lspropyl analog, 5; BDBM81916
MW:     377.459460 g/mol MF: C21H19N3O2S
IUPAC name: (6Z)-3-hydroxy-6-(4-naphthalen-1-yl-5-sulfanylidene-1,2,4-tr...
Create Date: 2011-12-15
CID: 54592348

1033. Pepstatin analog, 9; BDBM59221
MW:     925.161340 g/mol MF: C49H76N6O11
IUPAC name: (2S)-2-[[(2R)-4-amino-2-[[16-[[(2R)-1-[[(2R)-1-[2-(3,4-dimet...
Create Date: 2011-09-02
CID: 53348065

1034. Pepstatin analog, 8; BDBM59220
MW:     897.108180 g/mol MF: C47H72N6O11
IUPAC name: (2S)-2-[[(2R)-4-amino-2-[[16-[[(2R)-1-[[(2R)-1-[2-(3,4-dihyd...
Create Date: 2011-09-02
CID: 53348064

1035. Pepstatin analog, 7; BDBM59219
MW:     895.135360 g/mol MF: C48H74N6O10
IUPAC name: (2S)-2-[[(2R)-4-amino-2-[[16-[[(2R)-3-hydroxy-1-[[(2R)-1-[2-...
Create Date: 2011-09-02
CID: 53348063

1036. Pepstatin analog, 6; BDBM59218
MW:     881.108780 g/mol MF: C47H72N6O10
IUPAC name: (2S)-2-[[(2R)-4-amino-2-[[16-[[(2R)-3-hydroxy-1-[[(2R)-1-[2-...
Create Date: 2011-09-02
CID: 53348062

1037. Pepstatin analog, 5; BDBM59217
MW:     895.135360 g/mol MF: C48H74N6O10
IUPAC name: (2S)-2-[[(2R)-4-amino-2-[[16-[[(2R)-3-hydroxy-1-[[(2R)-1-[2-...
Create Date: 2011-09-02
CID: 53348061

1038. Pepstatin analog, 4; BDBM59216
MW:     881.108780 g/mol MF: C47H72N6O10
IUPAC name: (2S)-2-[[(2R)-4-amino-2-[[16-[[(2R)-3-hydroxy-1-[[(2R)-1-[2-...
Create Date: 2011-09-02
CID: 53348060

1039. Pepstatin analog, 3; BDBM59215
MW:     865.109380 g/mol MF: C47H72N6O9
IUPAC name: (2S)-2-[[(2R)-4-amino-2-[[16-[[(2S)-3-hydroxy-1-[[(2S)-4-met...
Create Date: 2011-09-02
CID: 53348059

1040. Pepstatin analog, 2; BDBM59214
MW:     908.134120 g/mol MF: C48H73N7O10
IUPAC name: (2R)-2-[[(2R)-4-amino-2-[[16-[[(2S)-1-[[(2S)-1-[[(2S)-1-amin...
Create Date: 2011-09-02
CID: 53348058

1041. Pepstatin analog, 1; BDBM59213
MW:    1575.885080 g/mol MF: C78H122N14O20
IUPAC name: (2S)-2-[[(2S)-4-amino-2-[[(2R)-2-[[(2R)-2-[[(2R)-2-[[16-[2-[...
Create Date: 2011-09-02
CID: 53348057

1042. Adenosine analog, 9; BDBM59204
MW:     351.361040 g/mol MF: C14H21N7O4
IUPAC name: (2S,3S,4R,5R)-N-(4-aminobutyl)-5-(6-aminopurin-9-yl)-3,4-dih...
Create Date: 2011-09-02
CID: 53348049

1043. Adenosine analog, 5; BDBM59202
MW:     337.334460 g/mol MF: C13H19N7O4
IUPAC name: (2S,3S,4R,5R)-5-[6-(2-aminoethylamino)purin-9-yl]-3,4-dihydr...
Create Date: 2011-09-02
CID: 53348047

1044. cambinol analog, 6j; CHEMBL522620; SCHEMBL12198696 ...
MW:     416.535260 g/mol MF: C25H24N2O2S
IUPAC name: 1-butyl-5-[(2-hydroxynaphthalen-1-yl)methyl]-6-phenyl-2-sulf...
Create Date: 2009-06-25
CID: 42617974

1045. cambinol analog, 6h; CHEMBL523988; SCHEMBL12198699 ...
MW:     402.508680 g/mol MF: C24H22N2O2S
IUPAC name: 5-[(2-hydroxynaphthalen-1-yl)methyl]-6-phenyl-1-propyl-2-sul...
Create Date: 2009-06-25
CID: 42617973

1046. cambinol analog, 6g; CHEMBL491106; SCHEMBL12198709 ...
MW:     400.492800 g/mol MF: C24H20N2O2S
IUPAC name: 5-[(2-hydroxynaphthalen-1-yl)methyl]-6-phenyl-1-prop-2-enyl-...
Create Date: 2009-06-25
CID: 42617972

1047. cambinol analog, 6f; CHEMBL522968; SCHEMBL12198694 ...
MW:     388.482100 g/mol MF: C23H20N2O2S
IUPAC name: 1-ethyl-5-[(2-hydroxynaphthalen-1-yl)methyl]-6-phenyl-2-sulf...
Create Date: 2009-06-25
CID: 42617971

1048. cambinol analog, 6e; CHEMBL490736; SCHEMBL1711140 ...
MW:     374.455520 g/mol MF: C22H18N2O2S
IUPAC name: 5-[(2-hydroxynaphthalen-1-yl)methyl]-1-methyl-6-phenyl-2-sul...
Create Date: 2009-06-25
CID: 42617970

1049. cambinol analog, 6x; CHEMBL491573; BDBM29054
MW:     378.419403 g/mol MF: C21H15FN2O2S
IUPAC name: 6-(2-fluorophenyl)-5-[(2-hydroxynaphthalen-1-yl)methyl]-2-su...
Create Date: 2009-06-25
CID: 42617968

1050. cambinol analog, 6v; CHEMBL489533; BDBM29049
MW:     486.325470 g/mol MF: C21H15IN2O2S
IUPAC name: 5-[(2-hydroxynaphthalen-1-yl)methyl]-6-(4-iodophenyl)-2-sulf...
Create Date: 2009-06-25
CID: 42617963

1051. cambinol analog, 6i; CHEMBL491927; BDBM29045
MW:     374.455520 g/mol MF: C22H18N2O2S
IUPAC name: 5-[(2-hydroxynaphthalen-1-yl)methyl]-6-(2-methylphenyl)-2-su...
Create Date: 2009-06-25
CID: 42617959

1052. cambinol analog, 6d; CHEMBL523653; SCHEMBL1711564 ...
MW:     386.466220 g/mol MF: C23H18N2O2S
IUPAC name: 5-[(2-hydroxy-5-phenylphenyl)methyl]-6-phenyl-2-sulfanyliden...
Create Date: 2009-06-25
CID: 42617958

1053. cambinol analog, 6c; CHEMBL491755; SCHEMBL2512264 ...
MW:     390.454920 g/mol MF: C22H18N2O3S
IUPAC name: 5-[(2-hydroxynaphthalen-1-yl)methyl]-6-(4-methoxyphenyl)-2-s...
Create Date: 2009-06-25
CID: 42617957

1054. cambinol analog, 6b; CHEMBL521799; SCHEMBL1711571 ...
MW:     439.325000 g/mol MF: C21H15BrN2O2S
IUPAC name: 6-(4-bromophenyl)-5-[(2-hydroxynaphthalen-1-yl)methyl]-2-sul...
Create Date: 2009-06-25
CID: 42617956

1055. cambinol analog, 6a; CHEMBL491961; SCHEMBL1711079 ...
MW:     344.363340 g/mol MF: C21H16N2O3
IUPAC name: 5-[(2-hydroxynaphthalen-1-yl)methyl]-6-phenyl-1H-pyrimidine-...
Create Date: 2009-06-25
CID: 42617955

1056. Azanium analog, 3; BDBM86551; ZINC09485749 ...
MW:     331.214320 g/mol MF: C15H18Cl2NO3+
IUPAC name: [5-(2,5-dichlorophenyl)furan-2-yl]methyl-(1,3-dihydroxy-2-me...
Create Date: 2009-05-30
CID: 41091195

1057. Azanium analog, 6; BDBM86554; [5-(4-Fluorophenyl)furan-2-yl]methyl-[(2-pyrazol-1-ylpyridin-3-yl)methyl]azanium
MW:     349.381523 g/mol MF: C20H18FN4O+
IUPAC name: [5-(4-fluorophenyl)furan-2-yl]methyl-[(2-pyrazol-1-ylpyridin...
Create Date: 2009-05-29
CID: 38052390

1058. Pyridone analog, 9; CHEMBL203773; BDBM17190 ...
MW:     467.515800 g/mol MF: C28H25N3O4
IUPAC name: 3-[4-[3-[4-[(2-methylphenyl)carbamoylamino]phenyl]-2-oxopyri...
Create Date: 2008-01-19
CID: 23647520

1059. Pyrrole Analogue 4; BDBM15014; N,N,N,N-Tetraethyl-5-formyl-3-methyl-1H-pyrrole-2,4-dicarboxamide ...
MW:     307.388000 g/mol MF: C16H25N3O3
IUPAC name: 2-N,2-N,4-N,4-N-tetraethyl-5-formyl-3-methyl-1H-pyrrole-2,4-...
Create Date: 2008-01-19
CID: 23646943

1060. CHEMBL206069; 5-amidino benzimidazole analog 1; BDBM14897 ...
MW:     444.439400 g/mol MF: C24H20N4O5
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646884

1061. 5-amidino benzimidazole analog 20; BDBM14344; CRA-18306 ...
MW:     487.421080 g/mol MF: C24H17N5O7-2
IUPAC name: (2R)-2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-yl...
Create Date: 2008-01-19
CID: 23646727

1062. 5-amidino benzimidazole analog 1; BDBM14340; CRA-16935 ...
MW:     442.423520 g/mol MF: C24H18N4O5-2
IUPAC name: (2R)-2-[(3Z)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-yl...
Create Date: 2008-01-19
CID: 23646723

1063. Amide Analogue 49; BDBM12467; 1-{[(4-Fluorobenzyl)amino]acetyl}-2-pyrrolidinecarbonitrile ...
MW:     261.294743 g/mol MF: C14H16FN3O
IUPAC name: (2S)-1-[2-[(4-fluorophenyl)methylamino]acetyl]pyrrolidine-2-...
Create Date: 2008-01-19
CID: 23646105

1064. Olefin Analogue 32; BDBM12450; benzyl(2-cyclohexylideneethyl)amine ...
MW:     215.333940 g/mol MF: C15H21N
IUPAC name: N-benzyl-2-cyclohexylideneethanamine
Create Date: 2008-01-19
CID: 23646104

1065. Olefin Analogue 31; BDBM12449; 10.8a ...
MW:     207.355000 g/mol MF: C14H25N
IUPAC name: N-(2-cyclohexylideneethyl)cyclohexanamine
Create Date: 2008-01-19
CID: 23646103

1066. Olefin Analogue 23; CHEMBL177472; BDBM12441 ...
MW:     201.307360 g/mol MF: C14H19N
IUPAC name: N-benzyl-2-cyclopentylideneethanamine
Create Date: 2008-01-19
CID: 23646102

1067. Olefin Analogue 22; CHEMBL176121; BDBM12440 ...
MW:     193.328420 g/mol MF: C13H23N
IUPAC name: N-(2-cyclopentylideneethyl)cyclohexanamine
Create Date: 2008-01-19
CID: 23646101

1068. sulfonamide analog 8; CHEMBL123222; BDBM10187 ...
MW:     498.546600 g/mol MF: C22H30N2O9S
IUPAC name: 5-[[6-[[(2S)-1-carboxy-3-oxopropan-2-yl]amino]-5-cyclopentyl...
Create Date: 2008-01-19
CID: 23645117

1069. sulfonamide analog 7; CHEMBL419233; BDBM10186 ...
MW:     520.552120 g/mol MF: C24H28N2O9S
IUPAC name: 5-[[5-benzyl-6-[[(2S)-1-carboxy-3-oxopropan-2-yl]amino]-6-ox...
Create Date: 2008-01-19
CID: 23645116

1070. sulfonamide analog 6; CHEMBL331922; BDBM10185 ...
MW:     486.535900 g/mol MF: C21H30N2O9S
IUPAC name: 5-[[5-[[(2S)-1-carboxy-3-oxopropan-2-yl]carbamoyl]-7-methylo...
Create Date: 2008-01-19
CID: 23645115

1071. sulfonamide analog 5; CHEMBL434411; BDBM10184 ...
MW:     472.509320 g/mol MF: C20H28N2O9S
IUPAC name: 5-[[5-[[(2S)-1-carboxy-3-oxopropan-2-yl]carbamoyl]-6-methylh...
Create Date: 2008-01-19
CID: 23645114

1072. sulfonamide analog 4; CHEMBL120323; BDBM10183 ...
MW:     472.509320 g/mol MF: C20H28N2O9S
IUPAC name: 5-[5-[[(2S)-1-carboxy-3-oxopropan-2-yl]carbamoyl]octylsulfam...
Create Date: 2008-01-19
CID: 23645113

1073. sulfonamide analog 3; CHEMBL121449; BDBM10182 ...
MW:     458.482740 g/mol MF: C19H26N2O9S
IUPAC name: 5-[5-[[(2S)-1-carboxy-3-oxopropan-2-yl]carbamoyl]heptylsulfa...
Create Date: 2008-01-19
CID: 23645112

1074. sulfonamide analog 2; CHEMBL445073; BDBM10181 ...
MW:     444.456160 g/mol MF: C18H24N2O9S
IUPAC name: 5-[[6-[[(2S)-1-carboxy-3-oxopropan-2-yl]amino]-5-methyl-6-ox...
Create Date: 2008-01-19
CID: 23645111

1075. Balanol analog 27; BDBM3161; 2-{[2,6-dihydroxy-4-({[(8S,9R)-9-[(4-hydroxybenzene)amido]tricyclo[5.2.1.0^{2,6}]decan-8-yl]oxy}carbonyl)phenyl]carbonyl}-3-hydroxybenzoic acid
MW:     587.573360 g/mol MF: C32H29NO10
Create Date: 2008-01-19
CID: 23644746

1076. CHEMBL263910; Balanol analog 26; BDBM3160 ...
MW:     587.573360 g/mol MF: C32H29NO10
Create Date: 2008-01-19
CID: 23644745

1077. thiazolone analog 1; SCHEMBL1606321; BDBM13738 ...
MW:     316.341910 g/mol MF: C14H15F3N2OS
IUPAC name: 5-methyl-5-propan-2-yl-2-[2-(trifluoromethyl)anilino]-1,3-th...
Create Date: 2008-01-19
CID: 23644674

1078. 5,6,7,8-tetrahydroacridine-2,9-diamine; Tacrine Analogue 8; CHEMBL61486 ...
MW:     213.278300 g/mol MF: C13H15N3
IUPAC name: 5,6,7,8-tetrahydroacridine-2,9-diamine
Create Date: 2007-08-20
CID: 16680726

1079. triazine analog 24; CHEMBL220640; SCHEMBL1265216 ...
MW:     524.613480 g/mol MF: C30H32N6O3
IUPAC name: N-(5-cyclohexyl-2-methoxyphenyl)-4-methyl-3-[3-[4-(methylami...
Create Date: 2007-06-18
CID: 16108981

1080. Lactam Analog 32; CHEMBL222068; BDBM14182 ...
MW:     345.437440 g/mol MF: C20H11NOS2
Create Date: 2007-06-18
CID: 16105515

1081. Lactam Analog 38; CHEMBL384914; BDBM14184 ...
MW:     327.399020 g/mol MF: C21H13NOS
Create Date: 2007-06-18
CID: 16105509

1082. Lactam Analog 37; CHEMBL220497; BDBM14183 ...
MW:     327.399020 g/mol MF: C21H13NOS
Create Date: 2007-06-18
CID: 16105508

1083. cyclohexene analog 6; CHEMBL216578; SCHEMBL3750136 ...
MW:     207.699260 g/mol MF: C12H14ClN
IUPAC name: (1S,6R)-6-(2-chlorophenyl)cyclohex-3-en-1-amine
Create Date: 2007-05-07
CID: 16049437

1084. Cyclic analogue, 7; BDBM84501; 23-Oxa-24,25-diazatetracyclo[18.2.1.12,5.17,10]pentacosa-2(25),3,5,7,9,15,20,22-octaene, 4-methoxy-, (5Z,15E)-
MW:     362.464740 g/mol MF: C23H26N2O2
Create Date: 2007-03-08
CID: 15955924

1085. Piperidine, 1-[[(phenylmethyl)amino]acetyl]-; 100875-44-3; Amide Analogue 35 ...
MW:     232.321400 g/mol MF: C14H20N2O
IUPAC name: 2-(benzylamino)-1-piperidin-1-ylethanone
Create Date: 2006-10-26
CID: 11776124

1086. Lactam analogue, 1; CHEMBL452478; SCHEMBL5618764 ...
MW:     281.312500 g/mol MF: C15H15N5O
IUPAC name: (2Z)-7,7-dimethyl-2-(5-methyl-1,2-dihydropyrazol-3-ylidene)-...
Create Date: 2006-10-26
CID: 11694813

1087. 1H-Pyrrole-2,4-dicarboxylic acid, 3-ethyl-5-formyl-, diethyl ester; 92042-64-3; Pyrrole Analogue 2 ...
MW:     267.277780 g/mol MF: C13H17NO5
IUPAC name: diethyl 3-ethyl-5-formyl-1H-pyrrole-2,4-dicarboxylate
Create Date: 2006-10-26
CID: 11687610

1088. Lactam analogue, 2; CHEMBL469197; SCHEMBL4945475 ...
MW:     309.365660 g/mol MF: C17H19N5O
IUPAC name: (2E)-5-ethyl-7,7-dimethyl-2-(5-methyl-1,2-dihydropyrazol-3-y...
Create Date: 2006-10-26
CID: 11638146

1089. Amide Analogue 26; CHEMBL175260; SCHEMBL10381350 ...
MW:     218.294820 g/mol MF: C13H18N2O
IUPAC name: 2-(benzylamino)-1-pyrrolidin-1-ylethanone
Create Date: 2006-10-26
CID: 11356421

1090. Tacrine Analogue 5; 7-nitro-1,2,3,4-tetrahydroacridin-9-amine; CHEMBL59977 ...
MW:     243.261220 g/mol MF: C13H13N3O2
IUPAC name: 7-nitro-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2006-10-26
CID: 11287987

1091. Amide Analogue 27; CHEMBL177644; BDBM12445 ...
MW:     262.304320 g/mol MF: C14H18N2O3
IUPAC name: 2-(1,3-benzodioxol-5-ylmethylamino)-1-pyrrolidin-1-ylethanon...
Create Date: 2006-10-26
CID: 11277009

1092. Olefin Analogue 33; BDBM12451; 10.8c ...
MW:     259.343440 g/mol MF: C16H21NO2
IUPAC name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyclohexylideneethanamine
Create Date: 2006-10-26
CID: 11242397

1093. Amide Analogue 25; CHEMBL177746; SCHEMBL5325757 ...
MW:     210.315880 g/mol MF: C12H22N2O
IUPAC name: 2-(cyclohexylamino)-1-pyrrolidin-1-ylethanone
Create Date: 2006-10-26
CID: 11229581

1094. Olefin Analogue 24; CHEMBL177823; BDBM12442 ...
MW:     245.316860 g/mol MF: C15H19NO2
IUPAC name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyclopentylideneethanamine
Create Date: 2006-10-26
CID: 11207320

1095. CHEMBL319080; Amide Analogue 48; SCHEMBL13316742 ...
MW:     287.399900 g/mol MF: C17H25N3O
IUPAC name: (2S)-1-[2-(1-adamantylamino)acetyl]pyrrolidine-2-carbonitril...
Create Date: 2006-10-26
CID: 11129932

1096. CHEMBL96942; Amide Analogue 47; BDBM12465 ...
MW:     257.330860 g/mol MF: C15H19N3O
IUPAC name: (2S)-1-[2-(2-phenylethylamino)acetyl]pyrrolidine-2-carbonitr...
Create Date: 2006-10-26
CID: 11076103

1097. Mecobalamin; methylcobalamin; 13422-55-4 ...
MW:    1344.382297 g/mol MF: C63H91CoN13O14P
IUPAC name: carbanide;cobalt(3+);[(2R,3S,4R,5S)-5-(5,6-dimethylbenzimida...
Create Date: 2006-10-26
CID: 10898559

1098. Tacrine Analogue 2; 6-methyl-1,2,3,4-tetrahydroacridin-9-amine; CHEMBL60119 ...
MW:     212.290240 g/mol MF: C14H16N2
IUPAC name: 6-methyl-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2006-10-26
CID: 10774917

1099. 6-chlorotacrine; Tacrine Analogue 4; 6-chlorotacrine.HCl ...
MW:     232.708720 g/mol MF: C13H13ClN2
IUPAC name: 6-chloro-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2006-10-25
CID: 10399068

1100. Amide Analogue 37; BDBM12455; 15.2d ...
MW:     315.453060 g/mol MF: C19H29N3O
IUPAC name: 2-[(1-benzylpiperidin-4-yl)amino]-1-piperidin-1-ylethanone
Create Date: 2006-10-25
CID: 10381005

1101. Amide Analogue 34; CHEMBL177696; BDBM12452 ...
MW:     224.342460 g/mol MF: C13H24N2O
IUPAC name: 2-(cyclohexylamino)-1-piperidin-1-ylethanone
Create Date: 2006-10-25
CID: 10242745

1102. indolinone analog 9; CHEMBL200721; SCHEMBL6675828 ...
MW:     332.352640 g/mol MF: C20H16N2O3
IUPAC name: (3Z)-5-(4-hydroxy-3-methoxyphenyl)-3-(1H-pyrrol-2-ylmethylid...
Create Date: 2006-10-25
CID: 10193410

1103. Amide Analogue 36; CHEMBL368869; BDBM12454 ...
MW:     276.330900 g/mol MF: C15H20N2O3
IUPAC name: 2-(1,3-benzodioxol-5-ylmethylamino)-1-piperidin-1-ylethanone
Create Date: 2006-10-25
CID: 10084828

1104. Tacrine Analogue 6; 6-nitro-1,2,3,4-tetrahydroacridin-9-amine; CHEMBL61715 ...
MW:     243.261220 g/mol MF: C13H13N3O2
IUPAC name: 6-nitro-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2006-10-25
CID: 10083133

1105. 6-fluoro-1,2,3,4-tetrahydroacridin-9-amine; 9-Acridinamine, 6-fluoro-1,2,3,4-tetrahydro-; 116207-35-3 ...
MW:     216.254123 g/mol MF: C13H13FN2
IUPAC name: 6-fluoro-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2006-10-25
CID: 10013554

1106. Pyrrole Analogue 5; SCHEMBL94996; CHEMBL561667 ...
MW:     295.330940 g/mol MF: C15H21NO5
IUPAC name: 2-O-tert-butyl 4-O-ethyl 3-ethyl-5-formyl-1H-pyrrole-2,4-dic...
Create Date: 2006-10-25
CID: 9965947

1107. Pyrrole Analogue 7; SCHEMBL94866; BDBM15017 ...
MW:     309.357520 g/mol MF: C16H23NO5
IUPAC name: 2-O-tert-butyl 4-O-ethyl 3-ethyl-5-formyl-1-methylpyrrole-2,...
Create Date: 2006-10-25
CID: 9944480

1108. Lactam Analog 26; CHEMBL375220; BDBM14181 ...
MW:     309.360600 g/mol MF: C22H15NO
Create Date: 2006-10-25
CID: 9904731

1109. Pyrrole Analogue 6; SCHEMBL94970; BDBM15016 ...
MW:     294.346180 g/mol MF: C15H22N2O4
IUPAC name: ethyl 5-(tert-butylcarbamoyl)-4-ethyl-2-formyl-1H-pyrrole-3-...
Create Date: 2006-10-25
CID: 9879198

1110. sulfonamide analog 9; CHEMBL331403; BDBM10188 ...
MW:     506.525540 g/mol MF: C23H26N2O9S
IUPAC name: 5-[[6-[[(2S)-1-carboxy-3-oxopropan-2-yl]amino]-6-oxo-5-pheny...
Create Date: 2006-10-25
CID: 9870833

1111. Xanthine Analogue 4; Xanthine mimetic compound 6; SCHEMBL555347 ...
MW:     393.442320 g/mol MF: C20H23N7O2
IUPAC name: 2-[[8-(3-aminopiperidin-1-yl)-1,3-dimethyl-2,6-dioxopurin-7-...
Create Date: 2006-10-25
CID: 9800721

1112. pyrazolo[3,4-b]pyridine analogue 7; AC1O6ZVG; BDBM8365 ...
MW:     328.753020 g/mol MF: C16H13ClN4O2
IUPAC name: N-[(6E)-6-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)-1,2-d...
Create Date: 2006-05-10
CID: 6539590

1113. CHEMBL260416; pyrazolo[3,4-b]pyridine analogue 6; AC1O6ZVE ...
MW:     373.204020 g/mol MF: C16H13BrN4O2
IUPAC name: N-[(6E)-6-(3-bromo-4-oxocyclohexa-2,5-dien-1-ylidene)-1,2-di...
Create Date: 2006-05-10
CID: 6539589

1114. Galbonolide B analog; AC1O52ET; (3R,7E,9S,12E,14S)-14-ethyl-5-hydroxy-5,13-bis(hydroxymethyl)-3,7,9-trimethyl-11-methylene-1-oxacyclotetradeca-7,12-diene-2,4-dione ...
MW:     380.475180 g/mol MF: C21H32O6
IUPAC name: (3R,7E,9S,12E,14S)-14-ethyl-5-hydroxy-5,13-bis(hydroxymethyl...
Create Date: 2006-04-29
CID: 6475984

1115. Pyranocoumarin analog; AC1O6FI2; CHEMBL462675 ...
MW:     330.374980 g/mol MF: C19H22O5
IUPAC name: 5,7-dimethoxy-8-[(E)-2-methylbut-2-enoyl]-4-propylchromen-2-...
Create Date: 2006-04-29
CID: 6474785

1116. Pyrazol analog, 2; AC1O1FG9; BDBM68230 ...
MW:     530.432730 g/mol MF: C23H13F3N4O6S
IUPAC name: 4-[(4Z)-4-[[5-(1,3-dioxoisoindol-5-yl)furan-2-yl]methylidene...
Create Date: 2005-09-14
CID: 6071284

1117. Balanol Benzophenone Ester Analog 9; AC1NS3KN; BDBM3254 ...
MW:     563.551960 g/mol MF: C30H29NO10
IUPAC name: [(1R,2R)-2-[(4-hydroxybenzoyl)amino]cyclopentyl] 3,5-dihydro...
Create Date: 2006-01-30
CID: 5328013

1118. Balanol Benzophenone Ester Analog 15; AC1NS3KK; CHEMBL66452 ...
MW:     549.525380 g/mol MF: C29H27NO10
IUPAC name: [(1R,2R)-2-[(4-hydroxybenzoyl)amino]cyclopentyl] 4-(2-ethoxy...
Create Date: 2006-01-30
CID: 5328012

1119. Balanol Benzophenone Ester Analog 24; AC1NS3K8; CHEMBL67528 ...
MW:     594.522940 g/mol MF: C29H26N2O12
IUPAC name: [(3R,4R)-4-[(4-hydroxybenzoyl)amino]pyrrolidin-3-yl] 4-[2-(a...
Create Date: 2006-01-30
CID: 5328008

1120. Balanol Benzophenone Ester Analog 20; AC1NS3K5; BDBM3248 ...
MW:     636.602680 g/mol MF: C32H32N2O12
IUPAC name: [(3R,4R)-4-[(4-hydroxybenzoyl)amino]pyrrolidin-3-yl] 4-[2-(2...
Create Date: 2006-01-30
CID: 5328007

1121. Balanol Benzophenone Ester Analog 19; AC1NS3K2; BDBM3247 ...
MW:     618.630460 g/mol MF: C33H34N2O10
IUPAC name: [(3R,4R)-4-[(4-hydroxybenzoyl)amino]pyrrolidin-3-yl] 4-[2-(c...
Create Date: 2006-01-30
CID: 5328006

1122. Balanol Benzophenone Ester Analog 18; AC1NS3JZ; CHEMBL68418 ...
MW:     578.566600 g/mol MF: C30H30N2O10
IUPAC name: [(3R,4R)-4-[(4-hydroxybenzoyl)amino]pyrrolidin-3-yl] 3,5-dih...
Create Date: 2006-01-30
CID: 5328005

1123. Balanol Benzophenone Ester Analog 17; AC1NS3JW; CHEMBL66750 ...
MW:     578.566600 g/mol MF: C30H30N2O10
IUPAC name: [(3R,4R)-4-[(4-hydroxybenzoyl)amino]pyrrolidin-3-yl] 4-(2-bu...
Create Date: 2006-01-30
CID: 5328004

1124. Balanol Benzophenone Ester Analog 25; AC1NS3JT; BDBM3244 ...
MW:     550.513440 g/mol MF: C28H26N2O10
IUPAC name: [(3R,4R)-4-[(4-hydroxybenzoyl)amino]pyrrolidin-3-yl] 4-(2-et...
Create Date: 2006-01-30
CID: 5328003

1125. Balanol Benzophenone Ester Analog 7; AC1NS3JQ; BDBM3243 ...
MW:     536.486860 g/mol MF: C27H24N2O10
IUPAC name: [(3R,4R)-4-[(4-hydroxybenzoyl)amino]pyrrolidin-3-yl] 3,5-dih...
Create Date: 2006-01-30
CID: 5328002

1126. Balanol Analog 41; AC1NS3EZ; CHEMBL48636 ...
MW:     521.472220 g/mol MF: C27H23NO10
IUPAC name: 2-[2,6-dihydroxy-4-[2-[(4-hydroxybenzoyl)amino]cyclopentyl]o...
Create Date: 2006-01-30
CID: 5327944

1127. sulfonamide analog 1; AC1NS24U; BDBM266 ...
MW:     430.429580 g/mol MF: C17H22N2O9S
IUPAC name: 5-[[6-[[(2S)-1-carboxy-3-oxopropan-2-yl]amino]-6-oxohexyl]su...
Create Date: 2006-01-30
CID: 5327336

1128. 1,2,3,4-Tetrahydro-6-methoxy-9-acridinamine; 6-methoxy-1,2,3,4-tetrahydroacridin-9-amine; 9-Acridinamine, 1,2,3,4-tetrahydro-6-methoxy- ...
MW:     228.289640 g/mol MF: C14H16N2O
IUPAC name: 6-methoxy-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2005-08-09
CID: 3075610

1129. CHEMBL105916; 6-FQXPT analog; AC1MHE9Y ...
MW:     460.322703 g/mol MF: C19H15BrFN5OS
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-(6-fluoro-4-oxopyrrolo[1,2-a]qu...
Create Date: 2005-08-01
CID: 3002311

1130. PT-306; 149485-92-7; Thiourea, N-(2-(2-fluorophenyl)ethyl)-N'-2-thiazolyl- ...
MW:     281.372183 g/mol MF: C12H12FN3S2
IUPAC name: 1-[2-(2-fluorophenyl)ethyl]-3-(1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001162

1131. PT-311; 149485-76-7; Thiourea, N-(2-(2-methoxyphenyl)ethyl)-N'-2-thiazolyl- ...
MW:     293.407700 g/mol MF: C13H15N3OS2
IUPAC name: 1-[2-(2-methoxyphenyl)ethyl]-3-(1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001083

1132. ST042013; Pyrazol analog, 4; AC1LOXJM ...
MW:     567.921490 g/mol MF: C24H17ClF3N3O6S
IUPAC name: ethyl 2-chloro-5-[5-[(Z)-[5-oxo-1-(4-sulfamoylphenyl)-3-(tri...
Create Date: 2005-07-10
CID: 1273149

1133. AN-989/40872714; Pyrazol analog, 3; AC1LO280 ...
MW:     533.476430 g/mol MF: C24H18F3N3O6S
IUPAC name: ethyl 4-[5-[(Z)-[5-oxo-1-(4-sulfamoylphenyl)-3-(trifluoromet...
Create Date: 2005-07-09
CID: 1232077

1134. 7-methyl-1,2,3,4-tetrahydroacridin-9-amine; 9-Acridinamine, 1,2,3,4-tetrahydro-7-methyl-; 5778-79-0 ...
MW:     212.290240 g/mol MF: C14H16N2
IUPAC name: 7-methyl-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2005-07-09
CID: 828189

1135. Chlorothiophos O-analog 2,5-isomer; AC1LBG6Z; CTK6G4395 ...
MW:     345.179162 g/mol MF: C11H15Cl2O4PS
IUPAC name: (2,5-dichloro-4-methylsulfanylphenyl) diethyl phosphate
Create Date: 2005-03-27
CID: 557396

1136. Aza-dipeptide analog; AC1LA58R; 1-Cyclohexyl-5(S)-2,5-bis[2-N-(methoxycarbonyl)-N-methyl[L-valinyl]amino]-4(S)-hydroxy-6-phenyl-2-azahexane ...
MW:     633.819100 g/mol MF: C33H55N5O7
IUPAC name: methyl N-[(2S)-1-[2-(cyclohexylmethyl)-2-[(2S,3S)-2-hydroxy-...
Create Date: 2005-08-01
CID: 461991

1137. 93806-77-0; AC1L9V2T; Uracil Polyoxin C analog(UPOC analog) ...
MW:     480.425360 g/mol MF: C20H24N4O10
IUPAC name: (2S)-2-[[(2R,3R)-2-amino-3-hydroxy-4-(4-hydroxyphenyl)butano...
Create Date: 2005-08-01
CID: 456525

1138. HEIT; 121749-88-0; 1-((2-Hydroxyethoxy)methyl)-6-iodo-thymine ...
MW:     326.088410 g/mol MF: C8H11IN2O4
IUPAC name: 1-(2-hydroxyethoxymethyl)-6-iodo-5-methylpyrimidine-2,4-dion...
Create Date: 2005-08-01
CID: 452078

1139. HEIU; 1-((2-Hydroxyethoxy)methyl)-6-iodo-uracil; 121749-84-6 ...
MW:     312.061830 g/mol MF: C7H9IN2O4
IUPAC name: 1-(2-hydroxyethoxymethyl)-6-iodopyrimidine-2,4-dione
Create Date: 2005-08-01
CID: 452074

1140. Azetomycin I; NSC244392; Actinomycin Az.beta. ...
MW:    1241.390460 g/mol MF: C61H84N12O16
IUPAC name: 2-amino-4,6-dimethyl-3-oxo-9-N-[7,11,14-trimethyl-2,5,9,12,1...
Create Date: 2005-03-26
CID: 428874

1141. CHEMBL317150; 11-ethylpaullone; NSC706122 ...
MW:     276.332440 g/mol MF: C18H16N2O
IUPAC name: 11-ethyl-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-one
Create Date: 2005-03-26
CID: 397719

1142. CHEMBL98501; 11-methylpaullone; NSC706120 ...
MW:     262.305860 g/mol MF: C17H14N2O
IUPAC name: 11-methyl-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-one
Create Date: 2005-03-26
CID: 397718

1143. CHEMBL316512; NSC703056; Paullone Analog 45 ...
MW:     317.169400 g/mol MF: C16H10Cl2N2O
IUPAC name: 8,10-dichloro-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-o...
Create Date: 2005-03-26
CID: 396572

1144. CHEMBL100309; NSC703054; Paullone Analog 37 ...
MW:     395.173310 g/mol MF: C17H10BrF3N2O
IUPAC name: 2-bromo-9-(trifluoromethyl)-7,12-dihydro-5H-indolo[3,2-d][1]...
Create Date: 2005-03-26
CID: 396571

1145. CHEMBL330398; NSC702373; Paullone Analog 47 ...
MW:     357.201320 g/mol MF: C17H13BrN2O2
IUPAC name: 9-bromo-4-methoxy-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin...
Create Date: 2005-03-26
CID: 396411

1146. CHEMBL431634; NSC701592; Paullone Analog 31 ...
MW:     308.331240 g/mol MF: C18H16N2O3
IUPAC name: 2,3-dimethoxy-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-o...
Create Date: 2005-03-26
CID: 396081

1147. CHEMBL99423; 4-methoxypaullone; NSC701591 ...
MW:     278.305260 g/mol MF: C17H14N2O2
IUPAC name: 4-methoxy-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-one
Create Date: 2005-03-26
CID: 396080

1148. CHEMBL319373; NSC700693; Paullone Analog 12 ...
MW:     387.227300 g/mol MF: C18H15BrN2O3
IUPAC name: 9-bromo-2,3-dimethoxy-7,12-dihydro-5H-indolo[3,2-d][1]benzaz...
Create Date: 2005-03-26
CID: 395805

1149. CHEMBL98360; NSC700692; 2,9-dibromopaullone ...
MW:     406.071400 g/mol MF: C16H10Br2N2O
IUPAC name: 2,9-dibromo-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-one
Create Date: 2005-03-26
CID: 395804

1150. CHEMBL329063; NSC699472; Paullone Analog 13 ...
MW:     359.174140 g/mol MF: C16H11BrN2O3
IUPAC name: 9-bromo-2,3-dihydroxy-7,12-dihydro-5H-indolo[3,2-d][1]benzaz...
Create Date: 2005-03-26
CID: 395170

1151. CHEMBL95477; NSC699471; Paullone Analog 44 ...
MW:     343.174740 g/mol MF: C16H11BrN2O2
IUPAC name: 9-bromo-4-hydroxy-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin...
Create Date: 2005-03-26
CID: 395169

1152. NSC675996; CHEMBL99037; 9-fluoro-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-one ...
MW:     266.269743 g/mol MF: C16H11FN2O
IUPAC name: 9-fluoro-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-one
Create Date: 2005-03-26
CID: 385070

1153. NSC675995; CHEMBL317964; 9-methyl-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-one ...
MW:     262.305860 g/mol MF: C17H14N2O
IUPAC name: 9-methyl-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-one
Create Date: 2005-03-26
CID: 385069

1154. NSC675994; CHEMBL95827; 9-methoxy-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-one ...
MW:     278.305260 g/mol MF: C17H14N2O2
IUPAC name: 9-methoxy-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-one
Create Date: 2005-03-26
CID: 385068

1155. NSC673433; CHEMBL318911; 11-bromo-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-one ...
MW:     327.175340 g/mol MF: C16H11BrN2O
IUPAC name: 11-bromo-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-one
Create Date: 2005-03-26
CID: 384146

1156. NSC672234; CHEMBL98554; 10-bromo-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-one ...
MW:     327.175340 g/mol MF: C16H11BrN2O
IUPAC name: 10-bromo-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-one
Create Date: 2005-03-26
CID: 383787

1157. NSC672233; CHEMBL318471; 11-Chloro-7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one ...
MW:     282.724340 g/mol MF: C16H11ClN2O
IUPAC name: 11-chloro-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-one
Create Date: 2005-03-26
CID: 383786

1158. NSC641167; CHEMBL316940; 2-Bromo-7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one ...
MW:     327.175340 g/mol MF: C16H11BrN2O
IUPAC name: 2-bromo-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-one
Create Date: 2005-03-26
CID: 369402

1159. 7-chloro-6-(dimethylamino)quinoline-5,8-dione; 59962-99-1; NSC81046 ...
MW:     236.654360 g/mol MF: C11H9ClN2O2
IUPAC name: 7-chloro-6-(dimethylamino)quinoline-5,8-dione
Create Date: 2005-03-26
CID: 255469

1160. Diethyl 5-formyl-3-methyl-1H-pyrrole-2,4-dicarboxylate; 2199-60-2; WPKKEQCPXUTCDZ-UHFFFAOYSA-N ...
MW:     253.251200 g/mol MF: C12H15NO5
IUPAC name: diethyl 5-formyl-3-methyl-1H-pyrrole-2,4-dicarboxylate
Create Date: 2005-03-26
CID: 223280

1161. MLS000737932; 5422-89-9; 5-(Hydroxymethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylicacid diethyl ester ...
MW:     255.267080 g/mol MF: C12H17NO5
IUPAC name: diethyl 5-(hydroxymethyl)-3-methyl-1H-pyrrole-2,4-dicarboxyl...
Create Date: 2005-03-26
CID: 138495

1162. Substance P; CCRIS 7229; Arg-Pro-Lys-Pro-Gln-Gln-Phe-Phe-Gly-Leu-Met-NH2 ...
MW:    1347.630020 g/mol MF: C63H98N18O13S
IUPAC name: (2S)-2-[[(2S)-1-[(2S)-6-amino-2-[[(2S)-1-[(2S)-2-amino-5-(di...
Create Date: 2005-08-01
CID: 36511

1163. Demeton-S; Demetonthiol; Thioldemeton ...
MW:     258.338422 g/mol MF: C8H19O3PS2
IUPAC name: 1-diethoxyphosphorylsulfanyl-2-ethylsulfanylethane
Create Date: 2005-03-27
CID: 24723

1164. BRN 0394541; 7-chloro-1,2,3,4-tetrahydroacridin-9-amine; ACRIDINE, 1,2,3,4-TETRAHYDRO-9-AMINO-7-CHLORO- ...
MW:     232.708720 g/mol MF: C13H13ClN2
IUPAC name: 7-chloro-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2005-08-08
CID: 22493

1165. MLS002701581; 140674-76-6; AG 957 ...
MW:     273.283900 g/mol MF: C15H15NO4
IUPAC name: methyl 4-[(2,5-dihydroxyphenyl)methylamino]benzoate
Create Date: 2005-03-25
CID: 2064

1166. Mpdhip; AC1L3TPJ; Cypridina luciferin analog ...
MW:     225.245940 g/mol MF: C13H11N3O
IUPAC name: 2-methyl-7-phenylimidazo[1,2-a]pyrazin-3-one
Create Date: 2005-08-08
CID: 121949

1167. Pseudopeptide Analogue; BDBM50111970
MW:    1983.375460 g/mol MF: C87H139N33O17S2
Create Date: 2015-10-09
CID: 91931936

1168. benzthiazole analog 3; BDBM14300; benzyl N-[(2S,4E)-6-amino-1-(1,3-benzothiazol-2-yl)-1-oxohex-4-en-2-yl]carbamate
MW:     395.474740 g/mol MF: C21H21N3O3S
IUPAC name: benzyl (NZ)-N-[6-amino-1-(1,3-benzothiazol-2-yl)-1-oxohexan-...
Create Date: 2015-10-06
CID: 91895899

1169. Acyclonucleotide analog; 3-benzoyl-1-[[1-(3-diethoxyphosphorylpropyl)-4,5-dihydrotriazol-4-yl]methyl]quinazoline-2,4-dione
MW:     527.509362 g/mol MF: C25H30N5O6P
IUPAC name: 3-benzoyl-1-[[1-(3-diethoxyphosphorylpropyl)-4,5-dihydrotria...
Create Date: 2015-01-21
CID: 86577311

1170. Tobramycin-Tobramycin; Tob-Tob dimer; Aminoglycoside analogue ...
MW:    1173.485720 g/mol MF: C44H88N10O18S4
IUPAC name: (2S,3S,4S,5R,6S)-4-amino-2-[2-[2-[2-[2-[[(2S,3S,4S,5R,6S)-4-...
Create Date: 2014-04-03
CID: 73346789

1171. TLM analog, 11; BDBM93054
MW:     432.574420 g/mol MF: C27H28O3S
IUPAC name: (5R)-5-methyl-5-[(1E)-2-methylbuta-1,3-dienyl]-3-[5-(4-pheny...
Create Date: 2013-06-10
CID: 71469217

1172. TLM analog, 10; BDBM93053
MW:     344.381640 g/mol MF: C18H16O5S
IUPAC name: 2-[(5R)-5-methyl-5-[(1E)-2-methylbuta-1,3-dienyl]-2,4-dioxot...
Create Date: 2013-06-10
CID: 71469113

1173. TLM analog, 17; BDBM93060
MW:     625.733983 g/mol MF: C30H32FN5O5S2
IUPAC name: 4-[(4-fluorophenyl)sulfonylamino]-N-[[1-[4-[(5R)-5-methyl-5-...
Create Date: 2013-06-10
CID: 71468994

1174. TLM analog, 12; BDBM93055
MW:     334.860260 g/mol MF: C18H19ClO2S
IUPAC name: (5R)-3-[2-(4-chlorophenyl)ethyl]-5-methyl-5-[(1E)-2-methylbu...
Create Date: 2013-06-10
CID: 71468991

1175. TLM analog, 16; BDBM93059
MW:     404.564320 g/mol MF: C26H28O2S
IUPAC name: (5R)-5-methyl-5-[(1E)-2-methylbuta-1,3-dienyl]-3-[4-(4-pheny...
Create Date: 2013-06-10
CID: 71468989

1176. TLM analog, 15; BDBM93058
MW:     362.913420 g/mol MF: C20H23ClO2S
IUPAC name: (5R)-3-[4-(4-chlorophenyl)butyl]-5-methyl-5-[(1E)-2-methylbu...
Create Date: 2013-06-10
CID: 71468877

1177. TLM analog, 14; BDBM93057
MW:     346.458823 g/mol MF: C20H23FO2S
IUPAC name: (5R)-3-[4-(4-fluorophenyl)butyl]-5-methyl-5-[(1E)-2-methylbu...
Create Date: 2013-06-10
CID: 71468876

1178. TLM analog, 13; BDBM93056
MW:     314.441780 g/mol MF: C19H22O2S
IUPAC name: (5R)-5-methyl-5-[(1E)-2-methylbuta-1,3-dienyl]-3-[2-(4-methy...
Create Date: 2013-06-10
CID: 71468875

1179. MPP analogue, 19; BDBM92983
MW:     234.315640 g/mol MF: C17H16N+
IUPAC name: 1-methyl-4-(naphthalen-1-ylmethyl)pyridin-1-ium
Create Date: 2013-05-31
CID: 71463437

1180. MPP analogue, 18; BDBM92982
MW:     202.247423 g/mol MF: C13H13FN+
IUPAC name: 4-[(2-fluorophenyl)methyl]-1-methylpyridin-1-ium
Create Date: 2013-05-31
CID: 71463436

1181. MPP analogue, 17; 1-Methyl-4-phenethylpyridinium; BDBM92981
MW:     198.283540 g/mol MF: C14H16N+
IUPAC name: 1-methyl-4-(2-phenylethyl)pyridin-1-ium
Create Date: 2013-05-31
CID: 71463435

1182. RY Analogue, 17; BDBM92376
MW:     449.504040 g/mol MF: C20H31N7O5
IUPAC name: (2S)-2-acetamido-5-(diaminomethylideneamino)-N-[(2S)-1-(ethy...
Create Date: 2013-02-27
CID: 70701977

1183. RY Analogue, 16; BDBM92375
MW:     420.505880 g/mol MF: C20H32N6O4
IUPAC name: (2S)-2-acetamido-5-(diaminomethylideneamino)-N-[(2S)-1-(ethy...
Create Date: 2013-02-27
CID: 70701976

1184. RY Analogue, 14; BDBM92374
MW:     435.477460 g/mol MF: C19H29N7O5
IUPAC name: (2S)-2-acetamido-5-(diaminomethylideneamino)-N-[(2S)-1-(ethy...
Create Date: 2013-02-27
CID: 70701975

1185. RY Analogue, 13; BDBM92373
MW:     434.297640 g/mol MF: C19H31BN6O5
IUPAC name: [4-[(2S)-2-[[(2S)-2-acetamido-5-(diaminomethylideneamino)pen...
Create Date: 2013-02-27
CID: 70701974

1186. RY Analogue, 12; BDBM92372
MW:     415.489360 g/mol MF: C20H29N7O3
IUPAC name: (2S)-2-acetamido-N-[(2S)-3-(4-cyanophenyl)-1-(ethylamino)-1-...
Create Date: 2013-02-27
CID: 70701973

1187. RY Analogue, 11; BDBM92371
MW:     420.505880 g/mol MF: C20H32N6O4
IUPAC name: (2S)-2-acetamido-5-(diaminomethylideneamino)-N-[(2S)-1-(ethy...
Create Date: 2013-02-27
CID: 70701972

1188. RY Analogue, 10; BDBM92370
MW:     408.470363 g/mol MF: C19H29FN6O3
IUPAC name: (2S)-2-acetamido-5-(diaminomethylideneamino)-N-[(2S)-1-(ethy...
Create Date: 2013-02-27
CID: 70701971

1189. Azanium analog, 59; BDBM86567
MW:     315.214920 g/mol MF: C15H18Cl2NO2+
IUPAC name: [5-(2,5-dichlorophenyl)furan-2-yl]methyl-(1-hydroxybutan-2-y...
Create Date: 2012-07-07
CID: 57340646

1190. Azanium analog, 32; BDBM86560
MW:     303.419180 g/mol MF: C18H27N2O2+
IUPAC name: [3-(2,3-dihydroindol-1-yl)-3-oxopropyl]-ethyl-(oxolan-2-ylme...
Create Date: 2012-07-07
CID: 57340645

1191. methoctramine analog 5; BDBM82559
MW:    1026.322800 g/mol MF: C60H75N13O3
IUPAC name: 11-[[6-[8-[6-[bis[(6-oxo-5H-pyrido[2,3-b][1,4]benzodiazepin-...
Create Date: 2012-07-07
CID: 57339689

1192. CHEMBL20846; Tipranavir analog  4; AC1LAHE8 ...
MW:     584.725040 g/mol MF: C34H36N2O5S
IUPAC name: N-[3-[1-[4-hydroxy-6-oxo-2-(2-phenylethyl)-2-propyl-3H-pyran...
Create Date: 2011-12-26
CID: 54688872

1193. Tipranavir analog  3; AC1LAHFN; CHEMBL326566 ...
MW:     551.668763 g/mol MF: C31H34FNO5S
IUPAC name: 4-fluoro-N-[3-[1-[4-hydroxy-6-oxo-2-(2-phenylethyl)-2-propyl...
Create Date: 2011-12-26
CID: 54688871

1194. Tipranavir analog  6; AC1LAQW6; SCHEMBL7405148 ...
MW:     537.670300 g/mol MF: C29H35N3O5S
IUPAC name: N-[3-[(1R)-1-[(2S)-4-hydroxy-6-oxo-2-(2-phenylethyl)-2-propy...
Create Date: 2011-12-26
CID: 54688067

1195. Tipranavir analog  8; AC1LAQW3; SCHEMBL7405184 ...
MW:     537.670300 g/mol MF: C29H35N3O5S
IUPAC name: N-[3-[(1S)-1-[(2S)-4-hydroxy-6-oxo-2-(2-phenylethyl)-2-propy...
Create Date: 2011-12-26
CID: 54688066

1196. Tipranavir analog  9; AC1LAQVX; SCHEMBL7401827 ...
MW:     537.670300 g/mol MF: C29H35N3O5S
IUPAC name: N-[3-[(1S)-1-[(2R)-4-hydroxy-6-oxo-2-(2-phenylethyl)-2-propy...
Create Date: 2011-12-26
CID: 54688065

1197. CHEMBL21188; N-[3-[1(R or S)-(4-Hydroxy-2-oxo-6-n-propyl-6(R or S)-phenethyl-5,6-dihydro-2H-pyran-3-yl)-propyl]-phenyl]-1-methyl-1H-imidazole-4-sulfonamide; N-[3-[1-(4-Hydroxy-2-oxo-6-phenylethyl-6-propyl-5,6-dihydro-2H-pyran-3-yl)-propyl]-phenyl]-1-methyl-1H-imidazole-4-sulfonamide ...
MW:     537.670300 g/mol MF: C29H35N3O5S
IUPAC name: N-[3-[1-[4-hydroxy-6-oxo-2-(2-phenylethyl)-2-propyl-3H-pyran...
Create Date: 2011-12-26
CID: 54687773

1198. CHEMBL21281; Tipranavir analog  2; AC1LAHE5 ...
MW:     558.687760 g/mol MF: C32H34N2O5S
IUPAC name: 4-cyano-N-[3-[1-[4-hydroxy-6-oxo-2-(2-phenylethyl)-2-propyl-...
Create Date: 2011-12-26
CID: 54685691

1199. Tipranavir analog  1; AC1LAQVO; CHEMBL115743 ...
MW:     533.678300 g/mol MF: C31H35NO5S
IUPAC name: N-[3-[1-[4-hydroxy-6-oxo-2-(2-phenylethyl)-2-propyl-3H-pyran...
Create Date: 2011-12-26
CID: 54685688

1200. Oryzalin Analogue, 4; BDBM81745
MW:     382.479280 g/mol MF: C20H22N4O2S
IUPAC name: 3,5-dicyano-4-(dipropylamino)-N-phenylbenzenesulfonamide
Create Date: 2011-12-15
CID: 54592312

1201. Analog of 4P1NPA
MW:     308.415600 g/mol MF: C24H20
IUPAC name: 6-phenyl-1-(1-phenylethyl)naphthalene
Create Date: 2011-09-25
CID: 53362045

1202. Azanium analog, 31; BDBM86559; Dimethyl-[2-methyl-1-[[(2R)-2-thiophen-2-ylpyrrolidine-1-carbonyl]amino]propan-2-yl]azanium
MW:     296.451440 g/mol MF: C15H26N3OS+
IUPAC name: dimethyl-[2-methyl-1-[[(2R)-2-thiophen-2-ylpyrrolidine-1-car...
Create Date: 2011-09-06
CID: 53350242

1203. Azanium analog, 29; BDBM86557; [(1R)-2-[(3,5-Dichlorobenzoyl)amino]-1-(furan-2-yl)ethyl]-dimethylazanium
MW:     328.213680 g/mol MF: C15H17Cl2N2O2+
IUPAC name: [(1R)-2-[(3,5-dichlorobenzoyl)amino]-1-(furan-2-yl)ethyl]-di...
Create Date: 2011-09-06
CID: 53350240

1204. Fumarranol Analog, 6; BDBM81353
MW:     343.256020 g/mol MF: C16H23BrO3
IUPAC name: (1S,5R)-5-(bromomethyl)-1-methoxy-6-[(2R,3R)-2-methyl-3-(3-m...
Create Date: 2011-09-02
CID: 53348179

1205. Adenosine analog, 8; CHEMBL2070506; BDBM59203
MW:     337.334460 g/mol MF: C13H19N7O4
IUPAC name: (2S,3S,4R,5R)-N-(3-aminopropyl)-5-(6-aminopurin-9-yl)-3,4-di...
Create Date: 2011-09-02
CID: 53348048

1206. PSTQ Analog, 9; BDBM93355; MolPort-021-805-786 ...
MW:     370.448660 g/mol MF: C17H14N4O2S2
IUPAC name: 3-(benzenesulfonyl)-5-ethylsulfanyltriazolo[1,5-a]quinazolin...
Create Date: 2010-09-07
CID: 46862402

1207. PSTQ Analog, 8; SCHEMBL8019079; BDBM93354 ...
MW:     310.330500 g/mol MF: C15H10N4O2S
IUPAC name: 3-(benzenesulfonyl)triazolo[1,5-a]quinazoline
Create Date: 2010-09-07
CID: 46862401

1208. CHEMBL376542; 6-guanidino-NECA; Adenosine analog, 6 ...
MW:     350.333220 g/mol MF: C13H18N8O4
IUPAC name: (2S,3S,4R,5R)-5-[6-(diaminomethylideneamino)purin-9-yl]-N-et...
Create Date: 2009-11-19
CID: 44420926

1209. Fumarranol Analog, 9; CHEMBL379636; BDBM81354
MW:     358.428140 g/mol MF: C21H26O5
IUPAC name: (1S,3E,5S)-3-(furan-2-ylmethylidene)-5-(hydroxymethyl)-1-met...
Create Date: 2009-11-19
CID: 44416082

1210. CHEMBL215931; Fumarranol Analog, 7; BDBM50194621 ...
MW:     278.343480 g/mol MF: C16H22O4
IUPAC name: (1S,5R)-1-methoxy-6-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)...
Create Date: 2009-11-19
CID: 44416055

1211. CHEMBL213526; Fumarranol Analog, 8; BDBM50194623 ...
MW:     264.359960 g/mol MF: C16H24O3
IUPAC name: (1S,5S)-5-(hydroxymethyl)-1-methoxy-6-[(2E)-6-methylhepta-2,...
Create Date: 2009-11-19
CID: 44415938

1212. CHEMBL378606; Adenosine analog, 7; MRS-3412 ...
MW:     295.254720 g/mol MF: C10H13N7O4
IUPAC name: (2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolane-2-c...
Create Date: 2009-11-19
CID: 44410673

1213. cyclosporin analogue 3; BDBM50119424; CID44361246 ...
MW:    1262.663200 g/mol MF: C64H115N11O14
IUPAC name: (3S,9R,15R,27S,33S)-3-hydroxy-21-(1-hydroxyethyl)-24-[(E,1R,...
Create Date: 2009-11-19
CID: 44361246

1214. cyclosporin analogue 5; BDBM50119438; CID44361206 ...
MW:    1216.637820 g/mol MF: C63H113N11O12
IUPAC name: (6S,9S,12R,18R,21R,24R)-3-butan-2-yl-30-ethyl-33-[(E,1R,2R)-...
Create Date: 2009-11-19
CID: 44361206

1215. cyclosporin analogue 1; BDBM50119428; CID44361112 ...
MW:    1188.584660 g/mol MF: C61H109N11O12
IUPAC name: (3S,6R,12R,15R,18R,33S)-24-ethyl-27-[(E,1R,2R)-1-hydroxy-2-m...
Create Date: 2009-11-19
CID: 44361112

1216. cyclosporin analogue 7; BDBM50119423; CID44361037 ...
MW:    1186.611840 g/mol MF: C62H111N11O11
IUPAC name: (3S,6S,9S,12R,18R,21R,24R)-30-ethyl-1,4,7,10,12,15,19,25,28-...
Create Date: 2009-11-19
CID: 44361037

1217. cyclosporin analogue 6; BDBM50119403; CID44361015 ...
MW:    1174.558080 g/mol MF: C60H107N11O12
IUPAC name: (6S,9S,12R,18R,21R,24R)-30-ethyl-33-[(E,1R,2R)-1-hydroxy-2-m...
Create Date: 2009-11-19
CID: 44361015

1218. cambinol analog, 6xi; CHEMBL448638; BDBM29055
MW:     378.419403 g/mol MF: C21H15FN2O2S
IUPAC name: 6-(3-fluorophenyl)-5-[(2-hydroxynaphthalen-1-yl)methyl]-2-su...
Create Date: 2009-06-25
CID: 42617969

1219. cambinol analog, 6ix; CHEMBL490904; BDBM29053
MW:     394.874000 g/mol MF: C21H15ClN2O2S
IUPAC name: 6-(3-chlorophenyl)-5-[(2-hydroxynaphthalen-1-yl)methyl]-2-su...
Create Date: 2009-06-25
CID: 42617967

1220. cambinol analog, 6vii; CHEMBL491568; BDBM29051
MW:     439.325000 g/mol MF: C21H15BrN2O2S
IUPAC name: 6-(2-bromophenyl)-5-[(2-hydroxynaphthalen-1-yl)methyl]-2-sul...
Create Date: 2009-06-25
CID: 42617965

1221. cambinol analog, 6vi; CHEMBL522762; BDBM29050
MW:     428.426910 g/mol MF: C22H15F3N2O2S
IUPAC name: 5-[(2-hydroxynaphthalen-1-yl)methyl]-2-sulfanylidene-6-[4-(t...
Create Date: 2009-06-25
CID: 42617964

1222. cambinol analog, 6iv; CHEMBL489532; BDBM29048
MW:     394.874000 g/mol MF: C21H15ClN2O2S
IUPAC name: 6-(4-chlorophenyl)-5-[(2-hydroxynaphthalen-1-yl)methyl]-2-su...
Create Date: 2009-06-25
CID: 42617962

1223. cambinol analog, 6iii; CHEMBL491896; BDBM29047
MW:     374.455520 g/mol MF: C22H18N2O2S
IUPAC name: 5-[(2-hydroxynaphthalen-1-yl)methyl]-6-(4-methylphenyl)-2-su...
Create Date: 2009-06-25
CID: 42617961

1224. cambinol analog, 6ii; CHEMBL489527; BDBM29046
MW:     374.455520 g/mol MF: C22H18N2O2S
IUPAC name: 5-[(2-hydroxynaphthalen-1-yl)methyl]-6-(3-methylphenyl)-2-su...
Create Date: 2009-06-25
CID: 42617960

1225. Azanium analog, 62; BDBM86570; [5-(2,5-Dichlorophenyl)furan-2-yl]methyl-propan-2-ylazanium
MW:     285.188940 g/mol MF: C14H16Cl2NO+
IUPAC name: [5-(2,5-dichlorophenyl)furan-2-yl]methyl-propan-2-ylazanium
Create Date: 2009-05-30
CID: 41494863

1226. Azanium analog, 63; BDBM86571; (1-Hydroxy-2-methylpropan-2-yl)-[[5-[3-(trifluoromethyl)phenyl]furan-2-yl]methyl]azanium
MW:     314.322770 g/mol MF: C16H19F3NO2+
IUPAC name: (1-hydroxy-2-methylpropan-2-yl)-[[5-[3-(trifluoromethyl)phen...
Create Date: 2009-05-30
CID: 41493323

1227. Azanium analog, 28; BDBM86556; [(2R)-2,3-Dihydro-1,4-benzodioxin-2-yl]methyl-(quinolin-8-ylmethyl)azanium
MW:     307.366360 g/mol MF: C19H19N2O2+
IUPAC name: [(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-(quinolin-8-yl...
Create Date: 2009-05-30
CID: 40135445

1228. amide analog., 20; CHEMBL256045; BDBM25998 ...
MW:     361.436920 g/mol MF: C22H23N3O2
IUPAC name: [4-[2-methyl-5-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]phenyl]...
Create Date: 2008-12-11
CID: 25093468

1229. amide analog., 19; CHEMBL401518; BDBM25997 ...
MW:     406.477540 g/mol MF: C23H26N4O3
IUPAC name: 4-[2-methyl-5-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-N-(2-mo...
Create Date: 2008-12-11
CID: 25093467

1230. buspirone analogue, 3; CHEMBL520024; BDBM25872 ...
MW:     414.499540 g/mol MF: C25H26N4O2
IUPAC name: 2-[3-(2-methyl-4-quinolin-2-ylpiperazin-1-yl)propyl]isoindol...
Create Date: 2008-12-11
CID: 25093402

1231. buspirone analogue, 2; CHEMBL485541; BDBM25871 ...
MW:     394.509900 g/mol MF: C23H30N4O2
IUPAC name: 1-[4-(2-methyl-4-quinolin-2-ylpiperazin-1-yl)butyl]piperidin...
Create Date: 2008-12-11
CID: 25093401

1232. buspirone analogue, 1; CHEMBL485540; BDBM25869 ...
MW:     428.526120 g/mol MF: C26H28N4O2
IUPAC name: 2-[4-(2-methyl-4-quinolin-2-ylpiperazin-1-yl)butyl]isoindole...
Create Date: 2008-12-11
CID: 25093400

1233. pyridyl analogue, 37; BDBM25187; 5-(2,2,2-trifluoroacetyl)pyridine-2-carboxamide
MW:     218.132710 g/mol MF: C8H5F3N2O2
IUPAC name: 5-(2,2,2-trifluoroacetyl)pyridine-2-carboxamide
Create Date: 2008-11-14
CID: 25023823

1234. Thiazole analogue, 9; CHEMBL519399; BDBM24522 ...
MW:     409.481400 g/mol MF: C20H15N3O3S2
IUPAC name: (5E)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-[(4-phenyl...
Create Date: 2008-10-21
CID: 24971241

1235. pyrone analogue, 40; CHEMBL451789; BDBM24455 ...
MW:     459.401106 g/mol MF: C25H15F2N3O4
IUPAC name: 5-(4-fluorophenyl)-N-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4...
Create Date: 2008-09-22
CID: 24901688

1236. Thiazole analogue, 7; thiazolidinone derivative, 7; CHEMBL405972 ...
MW:     321.805120 g/mol MF: C13H8ClN3OS2
IUPAC name: (5E)-5-[(3-chlorophenyl)methylidene]-2-(1,3-thiazol-2-ylamin...
Create Date: 2008-06-30
CID: 24824182

1237. Thiazole analogue, 5; thiazolidinone derivative, 5; CHEMBL272443 ...
MW:     332.357620 g/mol MF: C13H8N4O3S2
IUPAC name: (5E)-5-[(3-nitrophenyl)methylidene]-2-(1,3-thiazol-2-ylamino...
Create Date: 2008-06-30
CID: 24824181

1238. Thiazole analogue, 3; thiazolidinone derivative, 3; CHEMBL272444 ...
MW:     317.386040 g/mol MF: C14H11N3O2S2
IUPAC name: (5E)-5-[(4-methoxyphenyl)methylidene]-2-(1,3-thiazol-2-ylami...
Create Date: 2008-06-30
CID: 24824180

1239. Thiazole analogue, 1; thiazolidinone derivative, 1; CHEMBL259672 ...
MW:     303.359460 g/mol MF: C13H9N3O2S2
IUPAC name: (5E)-5-[(4-hydroxyphenyl)methylidene]-2-(1,3-thiazol-2-ylami...
Create Date: 2008-06-30
CID: 24824179

1240. Thiazole analogue, 8; thiazolidinone derivative, 8; CHEMBL414193 ...
MW:     321.805120 g/mol MF: C13H8ClN3OS2
IUPAC name: (5E)-5-[(2-chlorophenyl)methylidene]-2-(1,3-thiazol-2-ylamin...
Create Date: 2008-06-30
CID: 24824178

1241. Thiazole analogue, 4; thiazolidinone derivative, 4; CHEMBL407592 ...
MW:     332.357620 g/mol MF: C13H8N4O3S2
IUPAC name: (5E)-5-[(4-nitrophenyl)methylidene]-2-(1,3-thiazol-2-ylamino...
Create Date: 2008-06-30
CID: 24824039

1242. Thiazole analogue, 2; thiazolidinone derivative, 2; CHEMBL436670 ...
MW:     333.385440 g/mol MF: C14H11N3O3S2
IUPAC name: (5E)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-(1,3-thiaz...
Create Date: 2008-06-30
CID: 24824038

1243. Pyridone analog, 14; CHEMBL205480; BDBM17193 ...
MW:     467.515800 g/mol MF: C28H25N3O4
IUPAC name: 2-[4-[[3-[4-[(2-methylphenyl)carbamoylamino]phenyl]-2-oxopyr...
Create Date: 2008-01-19
CID: 23647522

1244. Pyridone analog, 13; CHEMBL205508; BDBM17192 ...
MW:     481.542380 g/mol MF: C29H27N3O4
IUPAC name: 3-[2-[[3-[4-[(2-methylphenyl)carbamoylamino]phenyl]-2-oxopyr...
Create Date: 2008-01-19
CID: 23647521

1245. N-oxide analog, 9k; CHEMBL226381; BDBM16793 ...
MW:     375.423740 g/mol MF: C21H21N5O2
IUPAC name: (2S)-1-[5-(6-hydroxy-3-methylpyrazolo[3,4-c]pyridin-5-yl)pyr...
Create Date: 2008-01-19
CID: 23647439

1246. 5-amidino benzimidazole analog 20; CHEMBL206726; SCHEMBL7253491 ...
MW:     489.436960 g/mol MF: C24H19N5O7
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646894

1247. indolinone analog 34; CHEMBL201597; BDBM14670 ...
MW:     408.408840 g/mol MF: C24H16N4O3
IUPAC name: 3-[(Z)-[6-(4-hydroxy-3-methoxyphenyl)-2-oxo-1H-indol-3-ylide...
Create Date: 2008-01-19
CID: 23646844

1248. indolinone analog 33; CHEMBL199918; BDBM14669 ...
MW:     332.352640 g/mol MF: C20H16N2O3
IUPAC name: (3Z)-6-(4-hydroxy-3-methoxyphenyl)-3-(1H-pyrrol-3-ylmethylid...
Create Date: 2008-01-19
CID: 23646843

1249. indolinone analog 27; CHEMBL438978; BDBM14663 ...
MW:     336.384400 g/mol MF: C20H20N2O3
IUPAC name: (3Z)-6-(4-hydroxy-3-methoxyphenyl)-3-(pyrrolidin-2-ylmethyli...
Create Date: 2008-01-19
CID: 23646842

1250. indolinone analog 26; CHEMBL200000; BDBM14662 ...
MW:     422.475180 g/mol MF: C27H22N2O3
IUPAC name: (3Z)-6-(4-hydroxy-3-methoxyphenyl)-3-[(5-methyl-3-phenyl-1H-...
Create Date: 2008-01-19
CID: 23646841

1251. indolinone analog 23; CHEMBL371934; BDBM14659 ...
MW:     300.353840 g/mol MF: C20H16N2O
IUPAC name: (3Z)-6-(4-methylphenyl)-3-(1H-pyrrol-3-ylmethylidene)-1H-ind...
Create Date: 2008-01-19
CID: 23646840

1252. indolinone analog 22; CHEMBL199308; BDBM14658 ...
MW:     370.324630 g/mol MF: C20H13F3N2O2
IUPAC name: (3Z)-3-(1H-pyrrol-3-ylmethylidene)-6-[4-(trifluoromethoxy)ph...
Create Date: 2008-01-19
CID: 23646839

1253. indolinone analog 21; CHEMBL200168; BDBM14657 ...
MW:     322.308186 g/mol MF: C19H12F2N2O
IUPAC name: (3Z)-6-(3,4-difluorophenyl)-3-(1H-pyrrol-3-ylmethylidene)-1H...
Create Date: 2008-01-19
CID: 23646838

1254. indolinone analog 20; CHEMBL381028; BDBM14656 ...
MW:     332.352640 g/mol MF: C20H16N2O3
IUPAC name: (3Z)-6-(4-hydroxy-2-methoxyphenyl)-3-(1H-pyrrol-3-ylmethylid...
Create Date: 2008-01-19
CID: 23646837

1255. indolinone analog 19; CHEMBL201649; BDBM14655 ...
MW:     301.341900 g/mol MF: C19H15N3O
IUPAC name: (3Z)-6-(4-aminophenyl)-3-(1H-pyrrol-3-ylmethylidene)-1H-indo...
Create Date: 2008-01-19
CID: 23646836

1256. indolinone analog 18; CHEMBL199643; BDBM14654 ...
MW:     302.326660 g/mol MF: C19H14N2O2
IUPAC name: (3Z)-6-(4-hydroxyphenyl)-3-(1H-pyrrol-3-ylmethylidene)-1H-in...
Create Date: 2008-01-19
CID: 23646835

1257. indolinone analog 17; CHEMBL370615; BDBM14653 ...
MW:     376.405200 g/mol MF: C22H20N2O4
IUPAC name: (3Z)-3-(1H-pyrrol-3-ylmethylidene)-6-(3,4,5-trimethoxyphenyl...
Create Date: 2008-01-19
CID: 23646834

1258. indolinone analog 16; CHEMBL200933; BDBM14652 ...
MW:     403.427240 g/mol MF: C24H21NO5
IUPAC name: (3Z)-3-[(2,3-dimethoxyphenyl)methylidene]-6-(4-hydroxy-3-met...
Create Date: 2008-01-19
CID: 23646833

1259. indolinone analog 12; CHEMBL373004; BDBM14648 ...
MW:     403.427240 g/mol MF: C24H21NO5
IUPAC name: (3Z)-3-[(2,3-dimethoxyphenyl)methylidene]-5-(4-hydroxy-3-met...
Create Date: 2008-01-19
CID: 23646832

1260. indolinone analog 11; CHEMBL199973; BDBM14647 ...
MW:     396.437900 g/mol MF: C25H20N2O3
IUPAC name: (3Z)-5-(4-hydroxy-3-methoxyphenyl)-3-[(7-methyl-1H-indol-3-y...
Create Date: 2008-01-19
CID: 23646831

1261. indolinone analog 10; CHEMBL372771; BDBM14646 ...
MW:     382.411320 g/mol MF: C24H18N2O3
IUPAC name: (3Z)-5-(4-hydroxy-3-methoxyphenyl)-3-(1H-indol-3-ylmethylide...
Create Date: 2008-01-19
CID: 23646830

1262. benzthiazole analog 8; BDBM14305; benzyl N-[(2S)-1-(1,3-benzothiazol-2-yl)-3-(6-chloropyridin-3-yl)-1-oxopropan-2-yl]carbamate
MW:     451.925320 g/mol MF: C23H18ClN3O3S
IUPAC name: benzyl N-[(2S)-1-(1,3-benzothiazol-2-yl)-3-(6-chloropyridin-...
Create Date: 2008-01-19
CID: 23646712

1263. benzthiazole analog 7; BDBM14304; benzyl N-[(2S)-3-(3-amino-1H-indazol-5-yl)-1-(1,3-benzothiazol-2-yl)-1-oxopropan-2-yl]carbamate
MW:     471.530940 g/mol MF: C25H21N5O3S
IUPAC name: benzyl N-[(2S)-3-(3-amino-1H-indazol-5-yl)-1-(1,3-benzothiaz...
Create Date: 2008-01-19
CID: 23646711

1264. benzthiazole analog 6; BDBM14303; benzyl N-[(2S)-3-[(3R)-3-aminopyrrolidin-1-yl]-1-(1,3-benzothiazol-2-yl)-1-oxopropan-2-yl]carbamate
MW:     424.515960 g/mol MF: C22H24N4O3S
IUPAC name: benzyl N-[(2S)-3-[(3R)-3-aminopyrrolidin-1-yl]-1-(1,3-benzot...
Create Date: 2008-01-19
CID: 23646710

1265. benzthiazole analog 5; BDBM14302; benzyl N-[(2S)-3-(6-aminopyridin-3-yl)-1-(1,3-benzothiazol-2-yl)-1-oxopropan-2-yl]carbamate
MW:     432.494900 g/mol MF: C23H20N4O3S
IUPAC name: benzyl N-[(2S)-3-(6-aminopyridin-3-yl)-1-(1,3-benzothiazol-2...
Create Date: 2008-01-19
CID: 23646709

1266. benzthiazole analog 4; BDBM14301; benzyl N-[(2S)-1-(1,3-benzothiazol-2-yl)-1-oxo-3-{1H-pyrrolo[2,3-c]pyridin-2-yl}propan-2-yl]carbamate
MW:     456.516300 g/mol MF: C25H20N4O3S
IUPAC name: benzyl N-[(2S)-1-(1,3-benzothiazol-2-yl)-1-oxo-3-(1H-pyrrolo...
Create Date: 2008-01-19
CID: 23646708

1267. benzthiazole analog 2; BDBM14299; benzyl N-[(2S)-1-(1,3-benzothiazol-2-yl)-1-oxo-3-{1H-pyrrolo[3,2-c]pyridin-2-yl}propan-2-yl]carbamate
MW:     456.516300 g/mol MF: C25H20N4O3S
IUPAC name: benzyl N-[(2S)-1-(1,3-benzothiazol-2-yl)-1-oxo-3-(1H-pyrrolo...
Create Date: 2008-01-19
CID: 23646706

1268. Piperazone Analog 16; CHEMBL217015; BDBM13517 ...
MW:     311.327066 g/mol MF: C15H19F2N3O2
IUPAC name: (3R)-4-[(3R)-3-amino-4-(2,5-difluorophenyl)butanoyl]-3-methy...
Create Date: 2008-01-19
CID: 23646443

1269. Compound XV; CAAX Analogue 15; CHEMBL203879 ...
MW:     556.738300 g/mol MF: C25H40N4O6S2
IUPAC name: methyl (2S)-2-[[(2R)-2-[[(2S)-2-[[(2R)-2-amino-3-sulfanylpro...
Create Date: 2008-01-19
CID: 23646370

1270. Compound XIV; CAAX Analogue 14; CHEMBL204167 ...
MW:     556.738300 g/mol MF: C25H40N4O6S2
IUPAC name: methyl (2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-amino-3-sulfanylpro...
Create Date: 2008-01-19
CID: 23646369

1271. sulfonamide analog 36; CHEMBL333118; BDBM10214 ...
MW:     546.569480 g/mol MF: C24H22N2O9S2
IUPAC name: 5-[[5-[2-[[(2S)-1-carboxy-3-oxopropan-2-yl]amino]-2-oxo-1-ph...
Create Date: 2008-01-19
CID: 23645142

1272. sulfonamide analog 35; CHEMBL421070; BDBM10213 ...
MW:     512.553260 g/mol MF: C21H24N2O9S2
IUPAC name: 5-[[5-[1-[[(2S)-1-carboxy-3-oxopropan-2-yl]amino]-1-oxopenta...
Create Date: 2008-01-19
CID: 23645141

1273. sulfonamide analog 34; CHEMBL333919; BDBM10212 ...
MW:     470.473520 g/mol MF: C18H18N2O9S2
IUPAC name: 5-[[5-[2-[[(2S)-1-carboxy-3-oxopropan-2-yl]amino]-2-oxoethyl...
Create Date: 2008-01-19
CID: 23645140

1274. sulfonamide analog 33; CHEMBL334301; BDBM10211 ...
MW:     653.656340 g/mol MF: C31H31N3O11S
IUPAC name: 5-[[6-[[(2S)-3-carboxy-1-(7-methoxy-1,3-benzoxazol-2-yl)-1-o...
Create Date: 2008-01-19
CID: 23645139

1275. sulfonamide analog 32; CHEMBL123547; BDBM10210 ...
MW:     718.557760 g/mol MF: C32H29Cl2N3O10S
IUPAC name: 5-[[6-[[(2S)-3-carboxy-1-[5-(2,6-dichlorophenyl)-1,3-oxazol-...
Create Date: 2008-01-19
CID: 23645138

1276. sulfonamide analog 31; CHEMBL332851; BDBM10209 ...
MW:     677.184720 g/mol MF: C31H33ClN2O9S2
IUPAC name: 5-[[6-[[(2S)-1-carboxy-4-[(2-chlorophenyl)methylsulfanyl]-3-...
Create Date: 2008-01-19
CID: 23645137

1277. sulfonamide analog 30; CHEMBL119879; BDBM10208 ...
MW:     566.643700 g/mol MF: C25H30N2O9S2
IUPAC name: 5-[[6-[[(2S)-1-carboxy-4-methylsulfanyl-3-oxobutan-2-yl]amin...
Create Date: 2008-01-19
CID: 23645136

1278. sulfonamide analog 28; CHEMBL121123; BDBM10206 ...
MW:     544.576820 g/mol MF: C25H28N4O8S
IUPAC name: (3S)-3-[[6-[[3-(4-methyl-5-oxo-1,2,4-oxadiazol-3-yl)phenyl]s...
Create Date: 2008-01-19
CID: 23645134

1279. sulfonamide analog 27; CHEMBL121268; BDBM10205 ...
MW:     530.550240 g/mol MF: C24H26N4O8S
IUPAC name: (3S)-4-oxo-3-[[6-[[3-(5-oxo-2H-1,2,4-oxadiazol-3-yl)phenyl]s...
Create Date: 2008-01-19
CID: 23645133

1280. sulfonamide analog 26; CHEMBL331990; BDBM10204 ...
MW:     546.615840 g/mol MF: C24H26N4O7S2
IUPAC name: (3S)-4-oxo-3-[[6-[[3-(5-oxo-2H-1,2,4-thiadiazol-3-yl)phenyl]...
Create Date: 2008-01-19
CID: 23645132

1281. sulfonamide analog 25; CHEMBL123890; BDBM10203 ...
MW:     514.554140 g/mol MF: C23H26N6O6S
IUPAC name: (3S)-4-oxo-3-[[2-phenyl-6-[[3-(2H-tetrazol-5-yl)phenyl]sulfo...
Create Date: 2008-01-19
CID: 23645131

1282. sulfonamide analog 24; CHEMBL120088; BDBM10202 ...
MW:     490.526140 g/mol MF: C23H26N2O8S
IUPAC name: 3-[[6-[[(2S)-1-carboxy-3-oxopropan-2-yl]amino]-6-oxo-5-pheny...
Create Date: 2008-01-19
CID: 23645130

1283. sulfonamide analog 23; CHEMBL333944; BDBM10201 ...
MW:     462.516040 g/mol MF: C22H26N2O7S
IUPAC name: (3S)-3-[[6-[(4-hydroxyphenyl)sulfonylamino]-2-phenylhexanoyl...
Create Date: 2008-01-19
CID: 23645129

1284. sulfonamide analog 22; CHEMBL121798; BDBM10200 ...
MW:     446.516640 g/mol MF: C22H26N2O6S
IUPAC name: (3S)-3-[[6-(benzenesulfonamido)-2-phenylhexanoyl]amino]-4-ox...
Create Date: 2008-01-19
CID: 23645128

1285. sulfonamide analog 20; CHEMBL331572; BDBM10199 ...
MW:     512.553260 g/mol MF: C21H24N2O9S2
IUPAC name: 5-[[6-[[(2S)-1-carboxy-3-oxopropan-2-yl]amino]-6-oxo-5-thiop...
Create Date: 2008-01-19
CID: 23645127

1286. sulfonamide analog 19; CHEMBL121581; BDBM10198 ...
MW:     512.553260 g/mol MF: C21H24N2O9S2
IUPAC name: 5-[[6-[[(2S)-1-carboxy-3-oxopropan-2-yl]amino]-6-oxo-5-thiop...
Create Date: 2008-01-19
CID: 23645126

1287. sulfonamide analog 18; CHEMBL122316; BDBM10197 ...
MW:     520.552120 g/mol MF: C24H28N2O9S
IUPAC name: 5-[[6-[[(2S)-1-carboxy-3-oxopropan-2-yl]amino]-5-(4-methylph...
Create Date: 2008-01-19
CID: 23645125

1288. sulfonamide analog 17; CHEMBL121781; BDBM10196 ...
MW:     520.552120 g/mol MF: C24H28N2O9S
IUPAC name: 5-[[6-[[(2S)-1-carboxy-3-oxopropan-2-yl]amino]-5-(3-methylph...
Create Date: 2008-01-19
CID: 23645124

1289. sulfonamide analog 16; CHEMBL122827; BDBM10195 ...
MW:     520.552120 g/mol MF: C24H28N2O9S
IUPAC name: 5-[[6-[[(2S)-1-carboxy-3-oxopropan-2-yl]amino]-5-(2-methylph...
Create Date: 2008-01-19
CID: 23645123

1290. sulfonamide analog 15; CHEMBL121018; BDBM10194 ...
MW:     540.970600 g/mol MF: C23H25ClN2O9S
IUPAC name: 5-[[6-[[(2S)-1-carboxy-3-oxopropan-2-yl]amino]-5-(4-chloroph...
Create Date: 2008-01-19
CID: 23645122

1291. sulfonamide analog 13; CHEMBL121109; BDBM10192 ...
MW:     540.970600 g/mol MF: C23H25ClN2O9S
IUPAC name: 5-[[6-[[(2S)-1-carboxy-3-oxopropan-2-yl]amino]-5-(2-chloroph...
Create Date: 2008-01-19
CID: 23645121

1292. sulfonamide analog 12; CHEMBL121228; BDBM10191 ...
MW:     524.516003 g/mol MF: C23H25FN2O9S
IUPAC name: 5-[[6-[[(2S)-1-carboxy-3-oxopropan-2-yl]amino]-5-(4-fluoroph...
Create Date: 2008-01-19
CID: 23645120

1293. sulfonamide analog 11; CHEMBL121564; BDBM10190 ...
MW:     524.516003 g/mol MF: C23H25FN2O9S
IUPAC name: 5-[[6-[[(2S)-1-carboxy-3-oxopropan-2-yl]amino]-5-(3-fluoroph...
Create Date: 2008-01-19
CID: 23645119

1294. sulfonamide analog 10; CHEMBL121175; BDBM10189 ...
MW:     524.516003 g/mol MF: C23H25FN2O9S
IUPAC name: 5-[[6-[[(2S)-1-carboxy-3-oxopropan-2-yl]amino]-5-(2-fluoroph...
Create Date: 2008-01-19
CID: 23645118

1295. Tacrine Analogue 15; BDBM8998; CHEMBL418643 ...
MW:     333.383760 g/mol MF: C20H19N3O2
IUPAC name: N-benzyl-7-nitro-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2008-01-19
CID: 23644773

1296. BW19 analog 4; BDBM8939; 4-({9-methoxy-2-methyl-3-oxatricyclo[5.4.0.0;{2,4}]undeca-1(11),7,9-trien-4-yl}methyl)-1H-imidazole ...
MW:     270.326320 g/mol MF: C16H18N2O2
IUPAC name: 5-[(5-methoxy-7b-methyl-2,3-dihydronaphtho[1,2-b]oxiren-1a-y...
Create Date: 2008-01-19
CID: 23644752

1297. BW19 analog 3; BDBM8938; 7-(1H-Imidazol-5-ylmethyl)-8-methyl-5,6-dihydro-naphthalen-2,3-diol ...
MW:     256.299740 g/mol MF: C15H16N2O2
IUPAC name: 7-(1H-imidazol-5-ylmethyl)-8-methyl-5,6-dihydronaphthalene-2...
Create Date: 2008-01-19
CID: 23644751

1298. BW19 analog 2; BDBM8937; 7-(1H-imidazol-5-ylmethyl)-3-methoxy-8-methyl-5,6-dihydronaphthalen-2-ol
MW:     270.326320 g/mol MF: C16H18N2O2
IUPAC name: 7-(1H-imidazol-5-ylmethyl)-3-methoxy-8-methyl-5,6-dihydronap...
Create Date: 2008-01-19
CID: 23644750

1299. BW19 analog 1; BDBM8936; 6-(1H-imidazol-5-ylmethyl)-5-methyl-7,8-dihydronaphthalen-2-ol
MW:     240.300340 g/mol MF: C15H16N2O
IUPAC name: 6-(1H-imidazol-5-ylmethyl)-5-methyl-7,8-dihydronaphthalen-2-...
Create Date: 2008-01-19
CID: 23644749

1300. indolinone analog 29; BDBM14665; (3Z)-6-(4-hydroxy-3-methoxyphenyl)-3-(1H-imidazol-2-ylmethylidene)-2,3-dihydro-1H-indol-2-one
MW:     333.340700 g/mol MF: C19H15N3O3
IUPAC name: (6Z)-3-(1,3-dihydroimidazol-2-ylidenemethyl)-6-(3-methoxy-4-...
Create Date: 2008-01-19
CID: 23644683

1301. benzthiazole analog 1; CHEMBL1081864; SCHEMBL17646391 ...
MW:     397.490620 g/mol MF: C21H23N3O3S
IUPAC name: benzyl N-[(2S)-6-amino-1-(1,3-benzothiazol-2-yl)-1-oxohexan-...
Create Date: 2008-01-19
CID: 23644679

1302. Analogue of 1a, 5; BDBM93082; MolPort-028-571-173 ...
MW:     306.317120 g/mol MF: C14H18N4O4
IUPAC name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-methylfuran-2-...
Create Date: 2007-12-05
CID: 22110757

1303. Analogue of 1a, 1; BDBM93080; MolPort-005-583-161 ...
MW:     352.408700 g/mol MF: C15H20N4O4S
IUPAC name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-methylbenzenes...
Create Date: 2007-11-13
CID: 17564369

1304. CHEMBL388586; Peptide analogue, 1; SCHEMBL4132720 ...
MW:     798.905443 g/mol MF: C41H51FN10O6
IUPAC name: N-[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-[[(2S)-1-amino-3-(1H-indol-3...
Create Date: 2007-09-27
CID: 16735569

1305. Pladienolide analog 9; BDBM36361; CID16202134 ...
MW:     970.985086 g/mol MF: C51H77BF2N4O11
Create Date: 2007-07-09
CID: 16202134

1306. Pladienolide analog 8; BDBM36360; CID16202133 ...
MW:     565.738540 g/mol MF: C31H51NO8
IUPAC name: [(2S,3S,4E,6S,7R,10R)-7,10-dihydroxy-2-[(2E,4E,6S)-7-[(2R,3R...
Create Date: 2007-07-09
CID: 16202133

1307. Phenserine analog 32; CHEMBL132285; BDBM10988 ...
MW:     394.509900 g/mol MF: C23H30N4O2
IUPAC name: [(3aR,8bS)-6-[(dimethylamino)methyl]-3,4,8b-trimethyl-2,3a-d...
Create Date: 2007-02-08
CID: 13006046

1308. 2-isopropylphenserine; Phenserine analog 17; CHEMBL130270 ...
MW:     379.495260 g/mol MF: C23H29N3O2
IUPAC name: [(3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]in...
Create Date: 2007-02-08
CID: 13006045

1309. Phenserine analog 16; 2,6-diethylphenserine; CHEMBL335167 ...
MW:     393.521840 g/mol MF: C24H31N3O2
IUPAC name: [(3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]in...
Create Date: 2007-02-08
CID: 13006044

1310. 6-methylphenserine; Phenserine analog 13; CHEMBL132531 ...
MW:     351.442100 g/mol MF: C21H25N3O2
IUPAC name: [(3aR,8bS)-3,4,6,8b-tetramethyl-2,3a-dihydro-1H-pyrrolo[2,3-...
Create Date: 2007-02-08
CID: 13006042

1311. N-methylphenserine; Phenserine analog 12; CHEMBL131825 ...
MW:     351.442100 g/mol MF: C21H25N3O2
IUPAC name: [(3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]in...
Create Date: 2007-02-08
CID: 13006041

1312. UNII-6HCR5N6952; 80629-35-2; Captopril bromo analog ...
MW:     264.116360 g/mol MF: C9H14BrNO3
IUPAC name: (2S)-1-[(2S)-3-bromo-2-methylpropanoyl]pyrrolidine-2-carboxy...
Create Date: 2007-02-08
CID: 12760206

1313. CAAX Analogue 10; CHEMBL426843; BDBM13367 ...
MW:     570.721820 g/mol MF: C25H38N4O7S2
IUPAC name: (2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-formamido-3-sulfanylpropan...
Create Date: 2006-10-26
CID: 11713906

1314. Cmpound XI; CAAX Analogue 11; CHEMBL381525 ...
MW:     570.721820 g/mol MF: C25H38N4O7S2
IUPAC name: (2S)-2-[[(2R)-2-[[(2S)-2-[[(2R)-2-formamido-3-sulfanylpropan...
Create Date: 2006-10-26
CID: 11613911

1315. (3r)-4-[(3r)-3-Amino-4-(2,4,5-Trifluorophenyl)butanoyl]-3-(2,2,2-Trifluoroethyl)-1,4-Diazepan-2-One; 2iit; Diazepanone Analog 1 ...
MW:     411.342079 g/mol MF: C17H19F6N3O2
IUPAC name: (3R)-4-[(3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-3-(2...
Create Date: 2006-10-26
CID: 11592154

1316. Compound XIII; CAAX Analogue 13; CHEMBL382174 ...
MW:     570.721820 g/mol MF: C25H38N4O7S2
IUPAC name: (2S)-2-[[(2R)-2-[[(2S)-2-[[(2R)-2-formamido-3-sulfanylpropan...
Create Date: 2006-10-26
CID: 11577773

1317. Compound XII; CAAX Analogue 12; CHEMBL203988 ...
MW:     570.721820 g/mol MF: C25H38N4O7S2
IUPAC name: (2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-formamido-3-sulfanylpropan...
Create Date: 2006-10-26
CID: 11563200

1318. Pyridine Analogue 23; CHEMBL197237; BDBM10354 ...
MW:     387.409680 g/mol MF: C18H17N3O5S
IUPAC name: 5-[(2S)-2-(pyridin-4-yloxymethyl)pyrrolidin-1-yl]sulfonyl-1H...
Create Date: 2006-10-26
CID: 11509301

1319. IST-1; Pyridine Analogue 20; CHEMBL197535 ...
MW:     387.409680 g/mol MF: C18H17N3O5S
IUPAC name: 5-[(2S)-2-(pyridin-3-yloxymethyl)pyrrolidin-1-yl]sulfonyl-1H...
Create Date: 2006-10-26
CID: 11509300

1320. amide analog., 18; CHEMBL401517; SCHEMBL5462174 ...
MW:     351.399040 g/mol MF: C20H21N3O3
IUPAC name: N-(3-hydroxypropyl)-4-[2-methyl-5-(5-methyl-1,3,4-oxadiazol-...
Create Date: 2006-10-26
CID: 11484931

1321. amide analog., 16; CHEMBL272750; SCHEMBL4856436 ...
MW:     294.304660 g/mol MF: C17H14N2O3
IUPAC name: 4-[2-methyl-5-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]benzoic ...
Create Date: 2006-10-26
CID: 11220119

1322. 6,7-dichloro-1,2,3,4-tetrahydroacridin-9-amine; 286438-23-1; Tacrine Analogue 10 ...
MW:     267.153780 g/mol MF: C13H12Cl2N2
IUPAC name: 6,7-dichloro-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2006-10-26
CID: 10801760

1323. 6,7-dimethoxy-1,2,3,4-tetrahydroacridin-9-amine; Tacrine Analogue 11; CHEMBL61929 ...
MW:     258.315620 g/mol MF: C15H18N2O2
IUPAC name: 6,7-dimethoxy-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2006-10-26
CID: 10801196

1324. Tacrine Analogue 20; BDBM9003; CHEMBL294525 ...
MW:     341.447280 g/mol MF: C20H27N3O2
IUPAC name: N-heptyl-6-nitro-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2006-10-26
CID: 10783430

1325. Tacrine Analogue 13; CHEMBL64465; BDBM8996 ...
MW:     302.412780 g/mol MF: C21H22N2
IUPAC name: N-benzyl-6-methyl-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2006-10-26
CID: 10780715

1326. Tacrine Analogue 14; CHEMBL59628; BDBM8997 ...
MW:     322.831260 g/mol MF: C20H19ClN2
IUPAC name: N-benzyl-6-chloro-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2006-10-25
CID: 10711007

1327. Tacrine Analogue 18; CHEMBL61221; BDBM9001 ...
MW:     310.476300 g/mol MF: C21H30N2
IUPAC name: N-heptyl-6-methyl-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2006-10-25
CID: 10662773

1328. Tacrine Analogue 17; CHEMBL61849; BDBM9000 ...
MW:     310.476300 g/mol MF: C21H30N2
IUPAC name: N-heptyl-7-methyl-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2006-10-25
CID: 10638726

1329. Tacrine Analogue 12; CHEMBL64815; BDBM8995 ...
MW:     302.412780 g/mol MF: C21H22N2
IUPAC name: N-benzyl-7-methyl-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2006-10-25
CID: 10518487

1330. Tacrine Analogue 16; CHEMBL61506; BDBM8999 ...
MW:     333.383760 g/mol MF: C20H19N3O2
IUPAC name: N-benzyl-6-nitro-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2006-10-25
CID: 10496874

1331. sulfonamide analog 14; CHEMBL123412; BDBM10193 ...
MW:     540.970600 g/mol MF: C23H25ClN2O9S
IUPAC name: 5-[[6-[[(2S)-1-carboxy-3-oxopropan-2-yl]amino]-5-(3-chloroph...
Create Date: 2006-10-25
CID: 10459952

1332. Tacrine Analogue 19; CHEMBL59782; 6-chloro-N-heptyl-1,2,3,4-tetrahydroacridin-9-amine ...
MW:     330.894780 g/mol MF: C20H27ClN2
IUPAC name: 6-chloro-N-heptyl-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2006-10-25
CID: 10426799

1333. Tacrine Analogue 22; CHEMBL61561; 6-fluoro-N-heptyl-1,2,3,4-tetrahydroacridin-9-amine ...
MW:     314.440183 g/mol MF: C20H27FN2
IUPAC name: 6-fluoro-N-heptyl-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2006-10-25
CID: 10425802

1334. CHEMBL299638; Kaspar; buspirone analogue, 6 ...
MW:     434.573760 g/mol MF: C26H34N4O2
IUPAC name: 8-[4-(4-quinolin-2-ylpiperazin-1-yl)butyl]-8-azaspiro[4.5]de...
Create Date: 2006-10-25
CID: 10365638

1335. indolinone analog 14; CHEMBL199296; SCHEMBL6676435 ...
MW:     382.411320 g/mol MF: C24H18N2O3
IUPAC name: (3Z)-6-(4-hydroxy-3-methoxyphenyl)-3-(1H-indol-3-ylmethylide...
Create Date: 2006-10-25
CID: 10309409

1336. JYL1421; SC-0030; JYL-1421 ...
MW:     423.567743 g/mol MF: C20H26FN3O2S2
IUPAC name: 1-[(4-tert-butylphenyl)methyl]-3-[[3-fluoro-4-(methanesulfon...
Create Date: 2006-10-25
CID: 10295883

1337. indolinone analog 15; CHEMBL370406; SCHEMBL6673392 ...
MW:     396.437900 g/mol MF: C25H20N2O3
IUPAC name: (3Z)-6-(4-hydroxy-3-methoxyphenyl)-3-[(7-methyl-1H-indol-3-y...
Create Date: 2006-10-25
CID: 10287456

1338. UNII-295414T63R; 295414T63R; Sildenafil analogue I ...
MW:     534.694560 g/mol MF: C24H34N6O4S2
IUPAC name: 5-[5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-2-propoxyphe...
Create Date: 2006-10-25
CID: 10230401

1339. Jte 013; JTE-013; 383150-41-2 ...
MW:     408.285060 g/mol MF: C17H19Cl2N7O
IUPAC name: 1-(2,6-dichloropyridin-4-yl)-3-[(1,3-dimethyl-4-propan-2-ylp...
Create Date: 2006-10-25
CID: 10223146

1340. indolinone analog 28; CHEMBL383316; SCHEMBL6671445 ...
MW:     383.399380 g/mol MF: C23H17N3O3
IUPAC name: (3Z)-6-(4-hydroxy-3-methoxyphenyl)-3-(1H-pyrrolo[2,3-b]pyrid...
Create Date: 2006-10-25
CID: 10215912

1341. P3 furan analog 4; BDBM9154; CHEMBL326796 ...
MW:     721.765190 g/mol MF: C38H42F3N5O6
IUPAC name: (2S)-1-[(2S,4R)-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4-dihydro-...
Create Date: 2006-10-25
CID: 10212348

1342. JYL-1511; 623166-14-3; UNII-9MD3654O9N ...
MW:     435.603260 g/mol MF: C21H29N3O3S2
IUPAC name: 1-[(4-tert-butylphenyl)methyl]-3-[[4-(methanesulfonamido)-3-...
Create Date: 2006-10-25
CID: 10203349

1343. indolinone analog 31; CHEMBL371011; SCHEMBL6859703 ...
MW:     445.553340 g/mol MF: C27H31N3O3
IUPAC name: (3Z)-3-[[4-[(dimethylamino)methyl]-5-methyl-3-propan-2-yl-1H...
Create Date: 2006-10-25
CID: 10173666

1344. indolinone analog 24; CHEMBL373252; SCHEMBL6862997 ...
MW:     360.405800 g/mol MF: C22H20N2O3
IUPAC name: (3Z)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-6-(4-hydro...
Create Date: 2006-10-25
CID: 10172394

1345. MK-056; CHEMBL228451; thiourea analogue, 1 ...
MW:     405.577280 g/mol MF: C20H27N3O2S2
IUPAC name: 1-[(4-tert-butylphenyl)methyl]-3-[[4-(methanesulfonamido)phe...
Create Date: 2006-10-25
CID: 10135969

1346. indolinone analog 30; CHEMBL200847; SCHEMBL6672419 ...
MW:     446.495040 g/mol MF: C26H26N2O5
IUPAC name: methyl 3-[5-[(Z)-[6-(4-hydroxy-3-methoxyphenyl)-2-oxo-1H-ind...
Create Date: 2006-10-25
CID: 10127458

1347. indolinone analog 32; CHEMBL199620; SCHEMBL6671939 ...
MW:     404.458360 g/mol MF: C24H24N2O4
IUPAC name: (3Z)-3-[[4-(2-hydroxyethyl)-3,5-dimethyl-1H-pyrrol-2-yl]meth...
Create Date: 2006-10-25
CID: 10126790

1348. indolinone analog 25; CHEMBL371931; SCHEMBL6671843 ...
MW:     388.458960 g/mol MF: C24H24N2O3
IUPAC name: (3Z)-6-(4-hydroxy-3-methoxyphenyl)-3-[(5-methyl-3-propan-2-y...
Create Date: 2006-10-25
CID: 10126538

1349. 43A; A-432411; 2ayp ...
MW:     332.352640 g/mol MF: C20H16N2O3
IUPAC name: (3Z)-6-(4-hydroxy-3-methoxyphenyl)-3-(1H-pyrrol-2-ylmethylid...
Create Date: 2006-10-25
CID: 10125830

1350. Pyridone analog, 11; Pyridone derivative, 2; CHEMBL206011 ...
MW:     511.568360 g/mol MF: C30H29N3O5
IUPAC name: 3-[4-[[3-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl...
Create Date: 2006-10-25
CID: 10097891

1351. buspirone analogue, 5; CHEMBL483176; BDBM25874 ...
MW:     414.499540 g/mol MF: C25H26N4O2
IUPAC name: 2-[4-(4-quinolin-2-ylpiperazin-1-yl)butyl]isoindole-1,3-dion...
Create Date: 2006-10-25
CID: 10093232

1352. buspirone analogue, 4; CHEMBL485542; BDBM25873 ...
MW:     448.600340 g/mol MF: C27H36N4O2
IUPAC name: 8-[4-(2-methyl-4-quinolin-2-ylpiperazin-1-yl)butyl]-8-azaspi...
Create Date: 2006-10-25
CID: 10003814

1353. CHEMBL129903; Adenosine analog, 1; BDBM50106539 ...
MW:     323.307880 g/mol MF: C12H17N7O4
IUPAC name: (2S,3S,4R,5R)-N-(2-aminoethyl)-5-(6-aminopurin-9-yl)-3,4-dih...
Create Date: 2006-10-25
CID: 9996282

1354. Pyridone analog, 12; CHEMBL206652; SCHEMBL5070985 ...
MW:     481.542380 g/mol MF: C29H27N3O4
IUPAC name: 3-[3-[[3-[4-[(2-methylphenyl)carbamoylamino]phenyl]-2-oxopyr...
Create Date: 2006-10-25
CID: 9982665

1355. Pyridone analog, 15; CHEMBL204778; SCHEMBL5069258 ...
MW:     453.489220 g/mol MF: C27H23N3O4
IUPAC name: 4-[[3-[4-[(2-methylphenyl)carbamoylamino]phenyl]-2-oxopyridi...
Create Date: 2006-10-25
CID: 9981351

1356. CHEMBL77076; Pyrazinone Analog 34; SCHEMBL14542855 ...
MW:     511.960740 g/mol MF: C24H26ClN7O4
IUPAC name: 3-amino-5-[1-[2-[(4-carbamimidoylphenyl)methylamino]-2-oxoet...
Create Date: 2006-10-25
CID: 9936190

1357. CHEMBL53153; sulfamidas3; Oryzalin Analogue, 3 ...
MW:     422.455480 g/mol MF: C18H22N4O6S
IUPAC name: 4-(dipropylamino)-3,5-dinitro-N-phenylbenzenesulfonamide
Create Date: 2006-10-25
CID: 9910120

1358. Pyridone analog, 10; Pyridone derivative, 11; CHEMBL206484 ...
MW:     481.542380 g/mol MF: C29H27N3O4
IUPAC name: 3-[4-[[3-[4-[(2-methylphenyl)carbamoylamino]phenyl]-2-oxopyr...
Create Date: 2006-10-25
CID: 9848051

1359. ST50166461; ZINC06550541; Thiazole analogue, 6 ...
MW:     321.805120 g/mol MF: C13H8ClN3OS2
IUPAC name: (5E)-5-[(4-chlorophenyl)methylidene]-2-(1,3-thiazol-2-ylamin...
Create Date: 2006-07-30
CID: 7996787

1360. [5-(3,5-dichlorophenyl)furan-2-yl]methyl-methylazanium; ZINC04942887; Azanium analog, 55 ...
MW:     257.135780 g/mol MF: C12H12Cl2NO+
IUPAC name: [5-(3,5-dichlorophenyl)furan-2-yl]methyl-methylazanium
Create Date: 2006-07-29
CID: 7425173

1361. [5-(3,5-dichlorophenyl)furan-2-yl]methyl-(2-hydroxyethyl)azanium; ZINC04942886; Azanium analog, 53 ...
MW:     287.161760 g/mol MF: C13H14Cl2NO2+
IUPAC name: [5-(3,5-dichlorophenyl)furan-2-yl]methyl-(2-hydroxyethyl)aza...
Create Date: 2006-07-29
CID: 7425172

1362. [5-(2,5-dichlorophenyl)furan-2-yl]methyl-ethylazanium; ZINC04942875; Azanium analog, 61 ...
MW:     271.162360 g/mol MF: C13H14Cl2NO+
IUPAC name: [5-(2,5-dichlorophenyl)furan-2-yl]methyl-ethylazanium
Create Date: 2006-07-29
CID: 7425155

1363. [5-(2,5-dichlorophenyl)furan-2-yl]methyl-[(2S)-2-hydroxypropyl]azanium; Azanium analog, 60; AC1OL9UU ...
MW:     301.188340 g/mol MF: C14H16Cl2NO2+
IUPAC name: [5-(2,5-dichlorophenyl)furan-2-yl]methyl-[(2S)-2-hydroxyprop...
Create Date: 2006-07-29
CID: 7425151

1364. [5-(2,5-dichlorophenyl)furan-2-yl]methyl-(2-hydroxyethyl)azanium; ZINC04942870; Azanium analog, 58 ...
MW:     287.161760 g/mol MF: C13H14Cl2NO2+
IUPAC name: [5-(2,5-dichlorophenyl)furan-2-yl]methyl-(2-hydroxyethyl)aza...
Create Date: 2006-07-29
CID: 7425146

1365. [5-(3,5-dichlorophenyl)furan-2-yl]methyl-(1-hydroxy-2-methylpropan-2-yl)azanium; ZINC04842427; Azanium analog, 56 ...
MW:     315.214920 g/mol MF: C15H18Cl2NO2+
IUPAC name: [5-(3,5-dichlorophenyl)furan-2-yl]methyl-(1-hydroxy-2-methyl...
Create Date: 2006-07-29
CID: 7380122

1366. [5-(2,5-dichlorophenyl)furan-2-yl]methyl-methylazanium; ZINC04842372; Azanium analog, 57 ...
MW:     257.135780 g/mol MF: C12H12Cl2NO+
IUPAC name: [5-(2,5-dichlorophenyl)furan-2-yl]methyl-methylazanium
Create Date: 2006-07-29
CID: 7380086

1367. [5-(3,5-dichlorophenyl)furan-2-yl]methyl-(2-methoxyethyl)azanium; ZINC04840966; Azanium analog, 54 ...
MW:     301.188340 g/mol MF: C14H16Cl2NO2+
IUPAC name: [5-(3,5-dichlorophenyl)furan-2-yl]methyl-(2-methoxyethyl)aza...
Create Date: 2006-07-29
CID: 7379361

1368. 5-({5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione; 5-[[5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione; Thiobarbituric acid-furan analogue 21 ...
MW:     400.759530 g/mol MF: C16H8ClF3N2O3S
IUPAC name: 5-[[5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl]methyli...
Create Date: 2006-05-10
CID: 6539646

1369. CHEMBL317657; 1-benzyl-N-[5-bromo-6-(furan-2-yl)-1H-pyrazolo[3,4-b]pyridin-3-yl]pyrrolidine-3-carboxamide; pyrazolo[3,4-b]pyridine analogue 38 ...
MW:     466.330500 g/mol MF: C22H20BrN5O2
IUPAC name: 1-benzyl-N-[5-bromo-6-(furan-2-yl)-1H-pyrazolo[3,4-b]pyridin...
Create Date: 2006-05-10
CID: 6539615

1370. CHEMBL101747; SB-739245-AC; pyrazolo[3,4-b]pyridine analogue 37 ...
MW:     448.379880 g/mol MF: C19H22BrN5OS
IUPAC name: N-(5-bromo-6-thiophen-2-yl-1H-pyrazolo[3,4-b]pyridin-3-yl)-2...
Create Date: 2006-05-10
CID: 6539614

1371. CHEMBL406644; N-[5-bromo-6-(1,3-thiazol-2-yl)-1H-pyrazolo[3,4-b]pyridin-3-yl]cyclopentanecarboxamide; pyrazolo[3,4-b]pyridine analogue 36 ...
MW:     392.273560 g/mol MF: C15H14BrN5OS
IUPAC name: N-[5-bromo-6-(1,3-thiazol-2-yl)-1H-pyrazolo[3,4-b]pyridin-3-...
Create Date: 2006-05-10
CID: 6539613

1372. CHEMBL261690; N-[5-bromo-6-(1,3-thiazol-2-yl)-1H-pyrazolo[3,4-b]pyridin-3-yl]cyclopropanecarboxamide; pyrazolo[3,4-b]pyridine analogue 35 ...
MW:     364.220400 g/mol MF: C13H10BrN5OS
IUPAC name: N-[5-bromo-6-(1,3-thiazol-2-yl)-1H-pyrazolo[3,4-b]pyridin-3-...
Create Date: 2006-05-10
CID: 6539612

1373. CHEMBL408564; SB-739452; N-[5-bromo-6-(furan-2-yl)-1H-pyrazolo[3,4-b]pyridin-3-yl]cyclopropanecarboxamide ...
MW:     347.166740 g/mol MF: C14H11BrN4O2
IUPAC name: N-[5-bromo-6-(furan-2-yl)-1H-pyrazolo[3,4-b]pyridin-3-yl]cyc...
Create Date: 2006-05-10
CID: 6539611

1374. CHEMBL101804; SB-743899; N-[6-(furan-2-yl)-1H-pyrazolo[3,4-b]pyridin-3-yl]cyclopropanecarboxamide ...
MW:     268.270680 g/mol MF: C14H12N4O2
IUPAC name: N-[6-(furan-2-yl)-1H-pyrazolo[3,4-b]pyridin-3-yl]cyclopropan...
Create Date: 2006-05-10
CID: 6539592

1375. CHEMBL407980; pyrazolo[3,4-b]pyridine analogue 32; AC1O6ZVI ...
MW:     391.285500 g/mol MF: C16H15BrN4OS
IUPAC name: N-(5-bromo-6-thiophen-2-yl-1H-pyrazolo[3,4-b]pyridin-3-yl)cy...
Create Date: 2006-05-10
CID: 6539591

1376. CHEMBL260231; pyrazolo[3,4-b]pyridine analogue 31; AC1O6ZVC ...
MW:     363.232340 g/mol MF: C14H11BrN4OS
IUPAC name: N-(5-bromo-6-thiophen-2-yl-1H-pyrazolo[3,4-b]pyridin-3-yl)cy...
Create Date: 2006-05-10
CID: 6539588

1377. Paullone Analogue 70; AC1O6YME; BDBM7335 ...
MW:     414.295700 g/mol MF: C20H20BrN3O2
IUPAC name: 3-(4-aminobutoxy)-9-bromo-7,12-dihydro-5H-indolo[3,2-d][1]be...
Create Date: 2006-05-10
CID: 6538760

1378. CHALCONE ANALOG; AC1O403Y; CHEMBL1974577 ...
MW:     388.412600 g/mol MF: C24H20O5
IUPAC name: (E)-3-(1,3-benzodioxol-5-yl)-1-(4-methoxy-2-phenylmethoxyphe...
Create Date: 2005-09-26
CID: 6296717

1379. Resorcinol analog, 1; AC1NW3KE; SCHEMBL930617 ...
MW:     335.379720 g/mol MF: C18H13N3O2S
IUPAC name: (4Z)-3-hydroxy-4-(4-naphthalen-1-yl-5-sulfanylidene-1,2,4-tr...
Create Date: 2005-07-15
CID: 5647328

1380. LAPACHOL ANALOG; AC1NUQTX; NSC356450 ...
MW:     404.410460 g/mol MF: C21H24O8
IUPAC name: 2-(3-methylbut-2-enyl)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-...
Create Date: 2006-02-27
CID: 5458822

1381. carbocyclic analog 20; AC1NS6JQ; BDBM5249 ...
MW:     300.350760 g/mol MF: C14H24N2O5
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-[(3S)-1-hydroxypentan-3-yl]...
Create Date: 2006-01-30
CID: 5329320

1382. carbocyclic analog 17; AC1NS6JK; BDBM5246 ...
MW:     314.334280 g/mol MF: C14H22N2O6
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-[(2R)-1-carboxybutan-2-yl]o...
Create Date: 2006-01-30
CID: 5329318

1383. (Alkylamino)piperidine BHAP Analog 8; AC1NS2PQ; BDBM1952 ...
MW:     512.667440 g/mol MF: C26H36N6O3S
IUPAC name: N-[2-[4-[methyl-[3-(2-methylbutan-2-ylamino)pyridin-2-yl]ami...
Create Date: 2006-01-30
CID: 5327621

1384. 4-(4-methylphenyl)-1H-pyrazole; 111016-46-7; pyrazole analogue, 6 ...
MW:     158.199800 g/mol MF: C10H10N2
IUPAC name: 4-(4-methylphenyl)-1H-pyrazole
Create Date: 2005-10-07
CID: 5212048

1385. 9-Heptylamino-6-methoxy-1,2,3,4-tetrahydroacridine; 9-Acridinamine, 1,2,3,4-tetrahydro-N-heptyl-6-methoxy-; 1,2,3,4-Tetrahydro-N-heptyl-6-methoxy-9-acridinamine ...
MW:     326.475700 g/mol MF: C21H30N2O
IUPAC name: N-heptyl-6-methoxy-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2005-08-09
CID: 3075611

1386. CHEMBL297702; 142336-22-9; 2,6-Piperidinedione,4,4-dimethyl-1-[4-[4-(2-quinolinyl)-1-piperazinyl]butyl]- ...
MW:     408.536480 g/mol MF: C24H32N4O2
IUPAC name: 4,4-dimethyl-1-[4-(4-quinolin-2-ylpiperazin-1-yl)butyl]piper...
Create Date: 2005-08-08
CID: 3025767

1387. PT-310; 172505-79-2; Thiourea, N-(2-(2-hydroxyphenyl)ethyl)-N'-2-thiazolyl- ...
MW:     279.381120 g/mol MF: C12H13N3OS2
IUPAC name: 1-[2-(2-hydroxyphenyl)ethyl]-3-(1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001170

1388. PETT CN deriv.; PETT Analog 42; AC1MHDKT ...
MW:     288.391180 g/mol MF: C13H12N4S2
IUPAC name: 1-(4-cyano-1,3-thiazol-2-yl)-3-(2-phenylethyl)thiourea
Create Date: 2005-08-01
CID: 3001110

1389. PETT Analog 41; AC1MHDKS; BDBM1874 ...
MW:     319.488040 g/mol MF: C16H21N3S2
IUPAC name: 1-(4-butyl-1,3-thiazol-2-yl)-3-(2-phenylethyl)thiourea
Create Date: 2005-08-01
CID: 3001109

1390. PT-316; Thiourea, N-(2-phenylethyl)-N'-(4-propyl-2-thiazolyl)-; 149486-74-8 ...
MW:     305.461460 g/mol MF: C15H19N3S2
IUPAC name: 1-(2-phenylethyl)-3-(4-propyl-1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001107

1391. PT-315; Thiourea, N-(4-ethyl-2-thiazolyl)-N'-(2-phenylethyl)-; 149485-47-2 ...
MW:     291.434880 g/mol MF: C14H17N3S2
IUPAC name: 1-(4-ethyl-1,3-thiazol-2-yl)-3-(2-phenylethyl)thiourea
Create Date: 2005-08-01
CID: 3001106

1392. 5-(4-chloro-benzenesulfonyl)-pyrimidine-2,4-diamine; 32083-43-5; ZINC00165976 ...
MW:     284.722060 g/mol MF: C10H9ClN4O2S
IUPAC name: 5-(4-chlorophenyl)sulfonylpyrimidine-2,4-diamine
Create Date: 2005-07-19
CID: 2819040

1393. 2-[(2,4-DICHLORO-5-METHYLPHENYL)SULFONYL]-1,3-DINITRO-5-(TRIFLUOROMETHYL)BENZENE; D3F; Compound 1 analog 3 ...
MW:     459.181390 g/mol MF: C14H7Cl2F3N2O6S
IUPAC name: 1,5-dichloro-2-[2,6-dinitro-4-(trifluoromethyl)phenyl]sulfon...
Create Date: 2005-07-19
CID: 2799606

1394. ZINC01036244; Compound 1 analog 6; AC1MDXNC ...
MW:     365.712190 g/mol MF: C13H7ClF3NO4S
IUPAC name: 1-(4-chlorophenyl)sulfonyl-2-nitro-4-(trifluoromethyl)benzen...
Create Date: 2005-07-19
CID: 2797358

1395. 4-({4-[(2,3,3-trichloroacryloyl)oxy]phenyl}sulphonyl)phenyl 2,3,3-trichloroacrylate; ZINC02155429; Compound 1 analog 4 ...
MW:     565.035520 g/mol MF: C18H8Cl6O6S
IUPAC name: [4-[4-(2,3,3-trichloroprop-2-enoyloxy)phenyl]sulfonylphenyl]...
Create Date: 2005-07-19
CID: 2774892

1396. 2-[(4-chlorophenyl)sulphonyl]-5-nitropyridinium-1-olate; 2-[(4-chlorophenyl)sulfonyl]-5-nitropyridinium-1-olate; ZINC02163160 ...
MW:     314.701680 g/mol MF: C11H7ClN2O5S
IUPAC name: 2-(4-chlorophenyl)sulfonyl-5-nitro-1-oxidopyridin-1-ium
Create Date: 2005-07-19
CID: 2774667

1397. ZINC00075474; Compound 1 analog 8; AC1MBILO ...
MW:     331.346420 g/mol MF: C15H13N3O4S
IUPAC name: 4,6-dimethyl-2-(4-methylphenyl)sulfonyl-5-nitropyridine-3-ca...
Create Date: 2005-07-19
CID: 2726176

1398. 4,6-dimethyl-5-nitro-2-(phenylsulfonyl)nicotinonitrile; 2-(benzenesulfonyl)-4,6-dimethyl-5-nitropyridine-3-carbonitrile; ZINC00075465 ...
MW:     317.319840 g/mol MF: C14H11N3O4S
IUPAC name: 2-(benzenesulfonyl)-4,6-dimethyl-5-nitropyridine-3-carbonitr...
Create Date: 2005-07-19
CID: 2726174

1399. 59843-75-3; 3-(p-Tolyl)-1H-pyrazole; 5-p-Tolyl-1H-pyrazole ...
MW:     158.199800 g/mol MF: C10H10N2
IUPAC name: 5-(4-methylphenyl)-1H-pyrazole
Create Date: 2005-07-19
CID: 2725023

1400. 3zll; Analogue of 1a, 2; 4as6 ...
MW:     233.223340 g/mol MF: C11H11N3O3
IUPAC name: 5-amino-1-benzyl-6-hydroxypyrimidine-2,4-dione
Create Date: 2005-07-09
CID: 909874

1401. 1-Benzyl-3-thiazol-2-yl-thiourea; Thiourea, N-(phenylmethyl)-N'-2-thiazolyl-; BAS 00581141 ...
MW:     249.355140 g/mol MF: C11H11N3S2
IUPAC name: 1-benzyl-3-(1,3-thiazol-2-yl)thiourea
Create Date: 2005-07-07
CID: 700723

1402. Acetyl fentanyl; 3258-84-2; N-(1-Phenethyl-piperidin-4-yl)-N-phenyl-acetamide ...
MW:     322.443940 g/mol MF: C21H26N2O
IUPAC name: N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide
Create Date: 2005-03-27
CID: 527015

1403. Nitidine cyclic analog; AC1LADS9; CTK6J9844 ...
MW:     391.416540 g/mol MF: C23H21NO5
Create Date: 2005-08-01
CID: 486159

1404. 1,3-Dioxane analog; AC1L9YTP; CTK7E0558 ...
MW:     331.221822 g/mol MF: C10H14N5O6P
IUPAC name: [(2S,4S)-4-[(2-amino-6-oxo-3H-purin-9-yl)methyl]-1,3-dioxan-...
Create Date: 2005-08-01
CID: 478531

1405. CHEMBL48257; Acylcarnitine analogue; Rac-Hemipalmitoylcarnitinium ...
MW:     399.607700 g/mol MF: C23H45NO4
IUPAC name: 2-[(2R,6S)-6-hydroxy-4,4-dimethyl-6-pentadecylmorpholin-4-iu...
Create Date: 2005-08-01
CID: 477539

1406. NSC641274; [(3R,5S)-5-(6-aminopurin-9-yl)tetrahydrofuran-3-yl]methanol; NSC633214 ...
MW:     235.242520 g/mol MF: C10H13N5O2
IUPAC name: [(3R,5S)-5-(6-aminopurin-9-yl)oxolan-3-yl]methanol
Create Date: 2005-08-01
CID: 469699

1407. CHEMBL67023; 5-methyl-2-[[(1S)-1-phenylethyl]amino]-3,1-benzoxazin-4-one; Benzoxazinone analogue ...
MW:     280.321140 g/mol MF: C17H16N2O2
IUPAC name: 5-methyl-2-[[(1S)-1-phenylethyl]amino]-3,1-benzoxazin-4-one
Create Date: 2005-08-01
CID: 468715

1408. CHEMBL124338; (Alkylamino)piperidine BHAP Analog 3; AC1LAH0E ...
MW:     484.614280 g/mol MF: C24H32N6O3S
IUPAC name: N-[2-[4-[methyl-[3-(propan-2-ylamino)pyridin-2-yl]amino]pipe...
Create Date: 2005-08-01
CID: 468315

1409. Michellamine B analog; AC1LA9XN; (1R,3R)-5-[4-hydroxy-3-(1-hydroxy-2-naphthyl)-1-naphthyl]-1,3-dimethyl-1,2,3,4-tetrahydroisoquinoline-6,8-diol ...
MW:     477.550380 g/mol MF: C31H27NO4
IUPAC name: (1R,3R)-5-[4-hydroxy-3-(1-hydroxynaphthalen-2-yl)naphthalen-...
Create Date: 2005-08-01
CID: 464517

1410. 1-[[5-[[(4-Methyl-1-piperazinyl)sulfonyl]amino]indol-2-yl]carbonyl]-4-[N-ethyl-N-[3-[(1,1-dimethylethyl)amino]-6-fluoro-2-pyridinyl]amino]piperidine; (Alkylamino)piperidine BHAP Analog 37; AC1LA7AW ...
MW:     614.777623 g/mol MF: C30H43FN8O3S
IUPAC name: N-[2-[4-[[3-(tert-butylamino)-6-fluoropyridin-2-yl]-ethylami...
Create Date: 2005-08-01
CID: 462988

1411. (Alkylamino)piperidine BHAP Analog 36; AC1LA7AT; BDBM2668 ...
MW:     578.723923 g/mol MF: C31H43FN8O2
IUPAC name: N-[2-[4-[[3-(tert-butylamino)-6-fluoropyridin-2-yl]-ethylami...
Create Date: 2005-08-01
CID: 462987

1412. 1-[(5-Methanesulfonamidoindol-2-yl)carbonyl]-4-[N-ethyl-N-[3-[(1,1-dimethylethyl)amino]-6-fluoro-2-pyridinyl]amino]piperidine; (Alkylamino)piperidine BHAP Analog 35; AC1LA7AQ ...
MW:     530.657903 g/mol MF: C26H35FN6O3S
IUPAC name: N-[2-[4-[[3-(tert-butylamino)-6-fluoropyridin-2-yl]-ethylami...
Create Date: 2005-08-01
CID: 462986

1413. (Alkylamino)piperidine BHAP Analog 33; AC1LA7AK; BDBM2665 ...
MW:     516.631323 g/mol MF: C25H33FN6O3S
IUPAC name: N-[2-[4-[ethyl-[6-fluoro-3-(propan-2-ylamino)pyridin-2-yl]am...
Create Date: 2005-08-01
CID: 462984

1414. 1-[(5-Methanesulfonamidoindol-2-yl)carbonyl]-4-[N-methyl-N-[6-chloro-3-[(1-methylethyl)amino]-2-pyridinyl]amino]piperidine; (Alkylamino)piperidine BHAP Analog 31; AC1LA7AE ...
MW:     519.059340 g/mol MF: C24H31ClN6O3S
IUPAC name: N-[2-[4-[[6-chloro-3-(propan-2-ylamino)pyridin-2-yl]-methyla...
Create Date: 2005-08-01
CID: 462982

1415. 1-[(5-Methanesulfonamidoindol-2-yl)carbonyl]-4-[N-methyl-N-[3-(isopropylamino)-2-pyridazinyl]amino]piperidine; (Alkylamino)piperidine BHAP Analog 30; AC1LA7AB ...
MW:     485.602340 g/mol MF: C23H31N7O3S
IUPAC name: N-[2-[4-[methyl-[4-(propan-2-ylamino)pyridazin-3-yl]amino]pi...
Create Date: 2005-08-01
CID: 462981

1416. (Alkylamino)piperidine BHAP Analog 29; AC1LA7A8; BDBM2661 ...
MW:     560.733460 g/mol MF: C31H44N8O2
IUPAC name: 4-methyl-N-[2-[4-[[3-(propan-2-ylamino)pyridin-2-yl]-propyla...
Create Date: 2005-08-01
CID: 462980

1417. 1-[[5-[[(4-Methyl-1-piperazinyl)sulfonyl]amino]indol-2-yl]carbonyl]-4-[N-ethyl-N-[3-[(1,1-dimethylethyl)amino]-2-pyridinyl]amino]piperidine; (Alkylamino)piperidine BHAP Analog 28; AC1LA7A5 ...
MW:     596.787160 g/mol MF: C30H44N8O3S
IUPAC name: N-[2-[4-[[3-(tert-butylamino)pyridin-2-yl]-ethylamino]piperi...
Create Date: 2005-08-01
CID: 462979

1418. 1-[[5-[[(4-Methyl-1-piperazinyl)carbonyl]amino]indol-2-yl]carbonyl]-4-[N-ethyl-N-[3-[(1,1-dimethylethyl)amino]-2-pyridinyl]amino]piperidine; (Alkylamino)piperidine BHAP Analog 27; AC1LA7A2 ...
MW:     560.733460 g/mol MF: C31H44N8O2
IUPAC name: N-[2-[4-[[3-(tert-butylamino)pyridin-2-yl]-ethylamino]piperi...
Create Date: 2005-08-01
CID: 462978

1419. (Alkylamino)piperidine BHAP Analog 26; AC1LA79Z; BDBM1970 ...
MW:     582.760580 g/mol MF: C29H42N8O3S
IUPAC name: N-[2-[4-[ethyl-[3-(propan-2-ylamino)pyridin-2-yl]amino]piper...
Create Date: 2005-08-01
CID: 462977

1420. 1-[[5-[[(4-Methyl-1-piperazinyl)carbonyl]amino]indol-2-yl]carbonyl]-4-[N-ethyl-N-[3-[(1-methylethyl)amino]-2-pyridinyl]amino]piperidine; (Alkylamino)piperidine BHAP Analog 25; AC1LA79W ...
MW:     546.706880 g/mol MF: C30H42N8O2
IUPAC name: N-[2-[4-[ethyl-[3-(propan-2-ylamino)pyridin-2-yl]amino]piper...
Create Date: 2005-08-01
CID: 462976

1421. (Alkylamino)piperidine BHAP Analog 24; AC1LA79T; BDBM1968 ...
MW:     568.734000 g/mol MF: C28H40N8O3S
IUPAC name: N-[2-[4-[ethyl-[3-(ethylamino)pyridin-2-yl]amino]piperidine-...
Create Date: 2005-08-01
CID: 462975

1422. (Alkylamino)piperidine BHAP Analog 23; AC1LA79Q; BDBM1967 ...
MW:     532.680300 g/mol MF: C29H40N8O2
IUPAC name: N-[2-[4-[ethyl-[3-(ethylamino)pyridin-2-yl]amino]piperidine-...
Create Date: 2005-08-01
CID: 462974

1423. (Alkylamino)piperidine BHAP Analog 22; AC1LA79N; BDBM1966 ...
MW:     498.640860 g/mol MF: C25H34N6O3S
IUPAC name: N-[2-[4-[ethyl-[3-(propylamino)pyridin-2-yl]amino]piperidine...
Create Date: 2005-08-01
CID: 462973

1424. 1-[(5-Methanesulfonamidoindol-2-yl)carbonyl]-4-[N-(1-methylethyl)-N-[3-(ethylamino)-2-pyridinyl]amino]piperidine; (Alkylamino)piperidine BHAP Analog 21; AC1LA79K ...
MW:     498.640860 g/mol MF: C25H34N6O3S
IUPAC name: N-[2-[4-[[3-(ethylamino)pyridin-2-yl]-propan-2-ylamino]piper...
Create Date: 2005-08-01
CID: 462972

1425. N-[2-({4-[[3-(Ethylamino)pyridin-2-yl](propyl)amino]piperidin-1-yl}carbonyl)-1H-indol-5-yl]methanesulfonamide; N-{2-[(4-{[3-(ethylamino)pyridin-2-yl](propyl)amino}piperidin-1-yl)carbonyl]-1H-indol-5-yl}methanesulfonamide; (Alkylamino)piperidine BHAP Analog 20 ...
MW:     498.640860 g/mol MF: C25H34N6O3S
IUPAC name: N-[2-[4-[[3-(ethylamino)pyridin-2-yl]-propylamino]piperidine...
Create Date: 2005-08-01
CID: 462971

1426. N-{2-[(4-{Ethyl[3-(ethylamino)pyridin-2-yl]amino}piperidin-1-yl)carbonyl]-1H-indol-5-yl}propane-2-sulfonamide; (Alkylamino)piperidine BHAP Analog 19; AC1LA79E ...
MW:     512.667440 g/mol MF: C26H36N6O3S
IUPAC name: N-[2-[4-[ethyl-[3-(ethylamino)pyridin-2-yl]amino]piperidine-...
Create Date: 2005-08-01
CID: 462970

1427. (Alkylamino)piperidine BHAP Analog 18; AC1LA79B; BDBM1962 ...
MW:     498.640860 g/mol MF: C25H34N6O3S
IUPAC name: N-[2-[4-[ethyl-[3-(ethylamino)pyridin-2-yl]amino]piperidine-...
Create Date: 2005-08-01
CID: 462969

1428. CHEMBL127283; 1-[(5-Methanesulfonamidoindol-2-yl)carbonyl]-4-[N-ethyl-N-[3-(ethylamino)-2-pyridinyl]amino]piperidine; (Alkylamino)piperidine BHAP Analog 17 ...
MW:     484.614280 g/mol MF: C24H32N6O3S
IUPAC name: N-[2-[4-[ethyl-[3-(ethylamino)pyridin-2-yl]amino]piperidine-...
Create Date: 2005-08-01
CID: 462968

1429. 1-[(5-Methanesulfonamidoindol-2-yl)carbonyl]-4-[N-propyl-N-[3-[(1,1-dimethylethyl)amino]-2-pyridinyl]amino]piperidine; (Alkylamino)piperidine BHAP Analog 16; AC1LA795 ...
MW:     526.694020 g/mol MF: C27H38N6O3S
IUPAC name: N-[2-[4-[[3-(tert-butylamino)pyridin-2-yl]-propylamino]piper...
Create Date: 2005-08-01
CID: 462967

1430. (Alkylamino)piperidine BHAP Analog 13; AC1LA78W; BDBM1957 ...
MW:     512.667440 g/mol MF: C26H36N6O3S
IUPAC name: N-[2-[4-[[3-(propan-2-ylamino)pyridin-2-yl]-propylamino]pipe...
Create Date: 2005-08-01
CID: 462964

1431. CHEMBL331330; (Alkylamino)piperidine BHAP Analog 12; AC1LA78T ...
MW:     498.640860 g/mol MF: C25H34N6O3S
IUPAC name: N-[2-[4-[ethyl-[3-(propan-2-ylamino)pyridin-2-yl]amino]piper...
Create Date: 2005-08-01
CID: 462963

1432. (Alkylamino)piperidine BHAP Analog 11; AC1LA78Q; BDBM1955 ...
MW:     496.624980 g/mol MF: C25H32N6O3S
IUPAC name: N-[2-[4-[methyl-[3-[(1-methylcyclopropyl)amino]pyridin-2-yl]...
Create Date: 2005-08-01
CID: 462962

1433. 1-[(5-Methanesulfonamidoindol-2-yl)carbonyl]-4-[N-methyl-N-[3-(cyclopropylamino)-2-pyridinyl]amino]piperidine; (Alkylamino)piperidine BHAP Analog 10; AC1LA78N ...
MW:     482.598400 g/mol MF: C24H30N6O3S
IUPAC name: N-[2-[4-[[3-(cyclopropylamino)pyridin-2-yl]-methylamino]pipe...
Create Date: 2005-08-01
CID: 462961

1434. 1-[(5-Methanesulfonamidoindol-2-yl)carbonyl]-4-[N-methyl-N-[3-[(cyclopropylmethyl)amino]-2-pyridinyl]amino]piperidine; (Alkylamino)piperidine BHAP Analog 9; AC1LA78K ...
MW:     496.624980 g/mol MF: C25H32N6O3S
IUPAC name: N-[2-[4-[[3-(cyclopropylmethylamino)pyridin-2-yl]-methylamin...
Create Date: 2005-08-01
CID: 462960

1435. CHEMBL338435; U-95133; 177577-59-2 ...
MW:     498.640860 g/mol MF: C25H34N6O3S
IUPAC name: N-[2-[4-[[3-(tert-butylamino)pyridin-2-yl]-methylamino]piper...
Create Date: 2005-08-01
CID: 462958

1436. (Alkylamino)piperidine BHAP Analog 6; AC1LA78B; BDBM1950 ...
MW:     421.535240 g/mol MF: C24H31N5O2
IUPAC name: [6-(hydroxymethyl)-1H-indol-2-yl]-[4-[methyl-[3-(propan-2-yl...
Create Date: 2005-08-01
CID: 462957

1437. (Alkylamino)piperidine BHAP Analog 5; AC1LA788; BDBM1949 ...
MW:     417.546540 g/mol MF: C25H31N5O
IUPAC name: [4-[cyclopropyl-[3-(propan-2-ylamino)pyridin-2-yl]amino]pipe...
Create Date: 2005-08-01
CID: 462956

1438. (Alkylamino)piperidine BHAP analog 4; AC1LA785; BDBM1948 ...
MW:     463.575220 g/mol MF: C25H33N7O2
IUPAC name: 1-methyl-3-[2-[4-[methyl-[3-(propan-2-ylamino)pyridin-2-yl]a...
Create Date: 2005-08-01
CID: 462955

1439. (Alkylamino)piperidine BHAP analog 2; AC1LA77Z; BDBM1946 ...
MW:     539.666340 g/mol MF: C29H41N5O5
IUPAC name: [6-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]-1H-indol-2-yl]-[4-[...
Create Date: 2005-08-01
CID: 462953

1440. CHEMBL151565; 1H-indol-2-yl-[4-[[3-(isopropylamino)-2-pyridyl]-methyl-amino]-1-piperidyl]methanone; (Alkylamino)piperidine BHAP Analog 1 ...
MW:     391.509260 g/mol MF: C23H29N5O
IUPAC name: 1H-indol-2-yl-[4-[methyl-[3-(propan-2-ylamino)pyridin-2-yl]a...
Create Date: 2005-08-01
CID: 462952

1441. Carboxamide analog 6; AC1LA5S6; BDBM9611 ...
MW:     615.759000 g/mol MF: C36H45N3O6
IUPAC name: benzyl (3R)-3-(butanoylamino)-4-[[(2S,3R)-4-[2-(tert-butylca...
Create Date: 2005-08-01
CID: 462281

1442. Carboxamide analog 5; AC1LA5S3; BDBM9610 ...
MW:     601.732420 g/mol MF: C35H43N3O6
IUPAC name: benzyl (3R)-4-[[(2S,3R)-4-[2-(tert-butylcarbamoyl)phenyl]-3-...
Create Date: 2005-08-01
CID: 462280

1443. Carboxamide analog 8; AC1L9T9Z; CHEMBL31266 ...
MW:     623.759540 g/mol MF: C33H41N3O7S
IUPAC name: benzyl (3R)-4-[[(2S,3R)-4-[2-(tert-butylcarbamoyl)phenyl]-3-...
Create Date: 2005-08-01
CID: 455648

1444. Carboxamide analog 7; AC1L9T9W; BDBM9612 ...
MW:     588.693900 g/mol MF: C33H40N4O6
IUPAC name: benzyl (3R)-4-[[(2S,3R)-4-[2-(tert-butylcarbamoyl)phenyl]-3-...
Create Date: 2005-08-01
CID: 455647

1445. Carboxamide analog 4; AC1L9T9Q; CHEMBL24442 ...
MW:     587.705840 g/mol MF: C34H41N3O6
IUPAC name: benzyl (3R)-3-acetamido-4-[[(2S,3R)-4-[2-(tert-butylcarbamoy...
Create Date: 2005-08-01
CID: 455645

1446. Carboxamide analog 3; AC1L9T9N; BDBM9608 ...
MW:     545.669160 g/mol MF: C32H39N3O5
IUPAC name: benzyl (3R)-3-amino-4-[[(2S,3R)-4-[2-(tert-butylcarbamoyl)ph...
Create Date: 2005-08-01
CID: 455644

1447. Carboxamide analog 2; AC1L9T9K; BDBM9607 ...
MW:     645.784980 g/mol MF: C37H47N3O7
IUPAC name: benzyl (3R)-4-[[(2S,3R)-4-[2-(tert-butylcarbamoyl)phenyl]-3-...
Create Date: 2005-08-01
CID: 455643

1448. 7-Deoxyisonarciclasine; (2S,3R,4S)-2,3,4-trihydroxy-2,3,4,5-tetrahydro-1H-[1,3]dioxolo[4,5-j]phenanthridin-6-one; Isonarciclasine analog ...
MW:     291.256120 g/mol MF: C14H13NO6
IUPAC name: (2S,3R,4S)-2,3,4-trihydroxy-2,3,4,5-tetrahydro-1H-[1,3]dioxo...
Create Date: 2005-08-01
CID: 454233

1449. HEPU; 123027-52-1; 1-((2-Hydroxyethoxy)methyl)-6-(phenylthio)uracil ...
MW:     294.326260 g/mol MF: C13H14N2O4S
IUPAC name: 1-(2-hydroxyethoxymethyl)-6-phenylsulfanylpyrimidine-2,4-dio...
Create Date: 2005-08-01
CID: 452069

1450. 2-5A Analog; AC1L9PQW; Adenosine-2',5'-phosphorothioate-nucleotide-trimer ...
MW:     955.768524 g/mol MF: C30H35N15O14P2S2-2
IUPAC name: (2R,5R)-2-(6-aminopurin-9-yl)-5-[[[(2R,5R)-2-(6-aminopurin-9...
Create Date: 2005-08-01
CID: 451591

1451. NECA; 5'-N-Ethylcarboxamidoadenosine; Adenosine-5'-(N-ethylcarboxamide) ...
MW:     308.293240 g/mol MF: C12H16N6O4
IUPAC name: (2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-N-ethyl-3,4-dihydroxyoxo...
Create Date: 2005-06-24
CID: 448222

1452. MLS000766022; SMR000279728; 6-nitro-2-(pyridin-3-ylmethyl)benzo[de]isoquinoline-1,3-dione ...
MW:     333.297640 g/mol MF: C18H11N3O4
IUPAC name: 6-nitro-2-(pyridin-3-ylmethyl)benzo[de]isoquinoline-1,3-dion...
Create Date: 2005-03-26
CID: 305244

1453. Benzylfentanyl; 1474-02-8; N-(1-Benzylpiperidin-4-yl)-N-phenylpropionamide ...
MW:     322.443940 g/mol MF: C21H26N2O
IUPAC name: N-(1-benzylpiperidin-4-yl)-N-phenylpropanamide
Create Date: 2005-03-26
CID: 252141

1454. chapso; 82473-24-3; MFCD00081079 ...
MW:     630.876520 g/mol MF: C32H58N2O8S
IUPAC name: 3-[dimethyl-[3-[[(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R...
Create Date: 2005-07-19
CID: 122145

1455. nonactin; Werramycin-A; Upjohn 170t (high melting) ...
MW:     736.928960 g/mol MF: C40H64O12
Create Date: 2005-03-26
CID: 72519

1456. Coumarin analogue, 3l; BDBM92554
MW:     453.512360 g/mol MF: C26H19N3O3S
IUPAC name: 3-[2-[(2-phenylmethoxyphenyl)methyldiazenyl]-1,3-thiazol-4-y...
Create Date: 2015-10-07
CID: 91899442

1457. Coumarin analogue, 3k; BDBM92553
MW:     423.441780 g/mol MF: C21H17N3O5S
IUPAC name: 3-[2-[(4-hydroxy-3,5-dimethoxyphenyl)methyldiazenyl]-1,3-thi...
Create Date: 2015-10-07
CID: 91899441

1458. Coumarin analogue, 3j; BDBM92552
MW:     437.468360 g/mol MF: C22H19N3O5S
IUPAC name: 3-[2-[(3,4,5-trimethoxyphenyl)methyldiazenyl]-1,3-thiazol-4-...
Create Date: 2015-10-07
CID: 91899440

1459. Coumarin analogue, 3i; BDBM92551
MW:     390.458220 g/mol MF: C21H18N4O2S
IUPAC name: 3-[2-[[4-(dimethylamino)phenyl]methyldiazenyl]-1,3-thiazol-4...
Create Date: 2015-10-07
CID: 91899439

1460. Coumarin analogue, 3h; BDBM92550
MW:     392.387980 g/mol MF: C19H12N4O4S
IUPAC name: 3-[2-[(4-nitrophenyl)methyldiazenyl]-1,3-thiazol-4-yl]chrome...
Create Date: 2015-10-07
CID: 91899438

1461. Coumarin analogue, 3g; BDBM92549
MW:     426.286480 g/mol MF: C19H12BrN3O2S
IUPAC name: 3-[2-[(4-bromophenyl)methyldiazenyl]-1,3-thiazol-4-yl]chrome...
Create Date: 2015-10-07
CID: 91899437

1462. Coumarin analogue, 3f; BDBM92548
MW:     426.286480 g/mol MF: C19H12BrN3O2S
IUPAC name: 3-[2-[(3-bromophenyl)methyldiazenyl]-1,3-thiazol-4-yl]chrome...
Create Date: 2015-10-07
CID: 91899436

1463. Coumarin analogue, 3e; BDBM92547
MW:     381.835480 g/mol MF: C19H12ClN3O2S
IUPAC name: 3-[2-[(4-chlorophenyl)methyldiazenyl]-1,3-thiazol-4-yl]chrom...
Create Date: 2015-10-07
CID: 91899435

1464. Coumarin analogue, 3d; BDBM92546
MW:     381.835480 g/mol MF: C19H12ClN3O2S
IUPAC name: 3-[2-[(3-chlorophenyl)methyldiazenyl]-1,3-thiazol-4-yl]chrom...
Create Date: 2015-10-07
CID: 91899434

1465. Coumarin analogue, 3c; BDBM92545
MW:     381.835480 g/mol MF: C19H12ClN3O2S
IUPAC name: 3-[2-[(2-chlorophenyl)methyldiazenyl]-1,3-thiazol-4-yl]chrom...
Create Date: 2015-10-07
CID: 91899433

1466. Coumarin analogue, 3b; BDBM92544
MW:     377.416400 g/mol MF: C20H15N3O3S
IUPAC name: 3-[2-[(4-methoxyphenyl)methyldiazenyl]-1,3-thiazol-4-yl]chro...
Create Date: 2015-10-07
CID: 91899432

1467. Coumarin analogue, 3a; BDBM92543
MW:     377.416400 g/mol MF: C20H15N3O3S
IUPAC name: 3-[2-[(3-methoxyphenyl)methyldiazenyl]-1,3-thiazol-4-yl]chro...
Create Date: 2015-10-07
CID: 91899431

1468. Compound 1 analog 10; BDBM11299; ethyl (2E)-2-cyano-3-({4-[(4-{[(1E)-2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl]amino}benzene)sulfonyl]phenyl}amino)prop-2-enoate
MW:     494.519680 g/mol MF: C24H22N4O6S
IUPAC name: ethyl 2-cyano-3-[4-[4-[(2-cyano-3-ethoxy-3-oxopropylidene)am...
Create Date: 2015-03-18
CID: 91593741

1469. Benzoquinone Analog 54; BDBM14602; BDBM50134405 ...
MW:     430.498940 g/mol MF: C25H26N4O3
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[2,5-dihydroxy-6-phenyl-...
Create Date: 2015-03-17
CID: 91439150

1470. Compound 1 analog 14; BDBM11303; 1,3-diethyl 2-[({4-[(4-{[3-ethoxy-2-(ethoxycarbonyl)-3-oxoprop-1-en-1-yl]amino}benzene)sulfonyl]phenyl}amino)methylidene]propanedioate
MW:     588.626080 g/mol MF: C28H32N2O10S
IUPAC name: diethyl 2-[[4-[4-[(3-ethoxy-2-ethoxycarbonyl-3-oxopropyliden...
Create Date: 2015-03-17
CID: 91230600

1471. Analogue of 1a, 8t; BDBM93093
MW:     376.387040 g/mol MF: C16H16N4O5S
IUPAC name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-N-methylfuran-2...
Create Date: 2013-05-31
CID: 71463475

1472. Analogue of 1a, 8c; BDBM93087
MW:     414.478080 g/mol MF: C20H22N4O4S
IUPAC name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-N-propylbenzene...
Create Date: 2013-05-31
CID: 71463474

1473. Analogue of 1a, 8b; BDBM93086
MW:     400.451500 g/mol MF: C19H20N4O4S
IUPAC name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-N-ethylbenzenes...
Create Date: 2013-05-31
CID: 71463473

1474. Vitamin D analog, 7; BDBM93072
MW:     388.583300 g/mol MF: C25H40O3
IUPAC name: (1R,3R)-5-[(2E)-2-[(7aR)-1-[(2S)-6-hydroxyhexan-2-yl]-7a-met...
Create Date: 2013-05-31
CID: 71463470

1475. Vitamin D analog, 8; BDBM93063
MW:     372.583900 g/mol MF: C25H40O2
IUPAC name: (1R,3R)-5-[(2E)-2-[(7aR)-1-[(2R)-hexan-2-yl]-7a-methyl-2,3,3...
Create Date: 2013-05-31
CID: 71463467

1476. Vitamin D analog, 6; BDBM93061
MW:     388.583300 g/mol MF: C25H40O3
IUPAC name: (1R,3R)-5-[(2E)-2-[(7aR)-1-[(2R)-6-hydroxyhexan-2-yl]-7a-met...
Create Date: 2013-05-31
CID: 71463465

1477. Glutamine Analogue, 5; BDBM93013
MW:     161.155840 g/mol MF: C6H11NO4
IUPAC name: 2-azaniumyl-5-methoxy-5-oxopentanoate
Create Date: 2013-05-31
CID: 71463447

1478. Glutamine Analogue, 3; BDBM93011
MW:     161.159140 g/mol MF: C5H11N3O3
IUPAC name: 2-azaniumyl-5-hydrazinyl-5-oxopentanoate
Create Date: 2013-05-31
CID: 71463446

1479. Analogue of 1a, 8p; BDBM93092; N-(6-Amino-1-Benzyl-2,4-Dioxo-1,2,3,4-Tetrahydropyrimidin-5-Yl)-N,3-Dimethylbenzenesulfonamide
MW:     400.451500 g/mol MF: C19H20N4O4S
IUPAC name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-N,3-dimethylben...
Create Date: 2012-11-02
CID: 66553091

1480. Analogue of 1a, 8k; BDBM93091; JWT ...
MW:     404.415383 g/mol MF: C18H17FN4O4S
IUPAC name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-4-fluoro-N-meth...
Create Date: 2012-11-02
CID: 66553090

1481. Analogue of 1a, 8j; BDBM93090; KKT ...
MW:     366.435280 g/mol MF: C16H22N4O4S
IUPAC name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-N-methylbutane-...
Create Date: 2012-11-02
CID: 66553089

1482. Analogue of 1a, 8a; BDBM93083; N-(6-Amino-1-Benzyl-2,4-Dioxo-1,2,3,4-Tetrahydropyrimidin-5-Yl)-N-Methylbenzenesulfonamide ...
MW:     386.424920 g/mol MF: C18H18N4O4S
IUPAC name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-N-methylbenzene...
Create Date: 2012-11-02
CID: 66553086

1483. Vitamin D analog, 9; SCHEMBL13343100; BDBM93064
MW:     372.583900 g/mol MF: C25H40O2
IUPAC name: (1R,3R)-5-[(2E)-2-[(7aR)-1-[(2S)-hexan-2-yl]-7a-methyl-2,3,3...
Create Date: 2012-08-19
CID: 58908332

1484. Glucosamine analog, 9; BDBM85425
MW:     298.291820 g/mol MF: C13H18N2O6
IUPAC name: 2-amino-N-[2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]benza...
Create Date: 2012-07-07
CID: 57340115

1485. Glucosamine analog, 8; BDBM85424
MW:     328.274740 g/mol MF: C13H16N2O8
IUPAC name: 3-nitro-N-[2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]benza...
Create Date: 2012-07-07
CID: 57340114

1486. Glucosamine analog, 7; BDBM85423
MW:     328.274740 g/mol MF: C13H16N2O8
IUPAC name: 2-nitro-N-[2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]benza...
Create Date: 2012-07-07
CID: 57340113

1487. Glucosamine analog, 4; BDBM85422
MW:     340.328500 g/mol MF: C15H20N2O7
IUPAC name: 2-acetamido-N-[2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]b...
Create Date: 2012-07-07
CID: 57340112

1488. Sulindac analogue, 24; BDBM84527
MW:     396.500800 g/mol MF: C26H20O2S
IUPAC name: 2-[(3Z)-2-ethyl-6-(2-phenylethynyl)-3-(thiophen-3-ylmethylid...
Create Date: 2012-07-07
CID: 57339736

1489. Sulindac analogue, 23; BDBM84526
MW:     422.536540 g/mol MF: C25H26O4S
IUPAC name: 2-[(3Z)-2-ethyl-6-[(E)-3-[(2-methylpropan-2-yl)oxy]-3-oxopro...
Create Date: 2012-07-07
CID: 57339735

1490. Sulindac analogue, 22; BDBM84525
MW:     508.347610 g/mol MF: C26H21IO3
IUPAC name: 2-[(3Z)-6-iodo-2-methyl-3-[(3-phenylmethoxyphenyl)methyliden...
Create Date: 2012-07-07
CID: 57339734

1491. Sulindac analogue, 21; BDBM84524
MW:     345.187320 g/mol MF: C17H13BrO3
IUPAC name: 2-[(3Z)-5-bromo-3-(furan-3-ylmethylidene)-2-methylinden-1-yl...
Create Date: 2012-07-07
CID: 57339733

1492. Sulindac analogue, 20; BDBM84523
MW:     361.252920 g/mol MF: C17H13BrO2S
IUPAC name: 2-[(3E)-5-bromo-2-methyl-3-(thiophen-3-ylmethylidene)inden-1...
Create Date: 2012-07-07
CID: 57339732

1493. Sulindac analogue, 11; BDBM84514
MW:     400.441543 g/mol MF: C26H21FO3
IUPAC name: 2-[(3Z)-6-fluoro-2-methyl-3-[(3-phenylmethoxyphenyl)methylid...
Create Date: 2012-07-07
CID: 57339731

1494. Acyclic analogue, 18; BDBM84512
MW:     372.458020 g/mol MF: C21H28N2O4
IUPAC name: (E)-11-[5-[(Z)-(3-methoxy-5-oxopyrrol-2-ylidene)methyl]-1H-p...
Create Date: 2012-07-07
CID: 57339730

1495. Acyclic analogue, 17; BDBM84510
MW:     218.251760 g/mol MF: C12H14N2O2
IUPAC name: (5Z)-5-[(5-ethyl-1H-pyrrol-2-yl)methylidene]-4-methoxypyrrol...
Create Date: 2012-07-07
CID: 57339729

1496. Acyclic analogue, 14; BDBM84508
MW:     267.325680 g/mol MF: C16H17N3O
IUPAC name: (2Z,5Z)-2-[(5-ethyl-1H-pyrrol-2-yl)methylidene]-3-methoxy-5-...
Create Date: 2012-07-07
CID: 57339728

1497. Acyclic analogue, 13; BDBM84507
MW:     321.416120 g/mol MF: C20H23N3O
IUPAC name: (2Z,5Z)-2-[(5-hex-5-enyl-1H-pyrrol-2-yl)methylidene]-3-metho...
Create Date: 2012-07-07
CID: 57339727

1498. Acyclic analogue, 12; BDBM84506
MW:     401.543840 g/mol MF: C26H31N3O
IUPAC name: (2Z,5Z)-5-[5-[(2Z)-hexa-2,5-dien-2-yl]pyrrol-2-ylidene]-2-[(...
Create Date: 2012-07-07
CID: 57339726

1499. Acyclic analogue, 11; BDBM84505
MW:     403.516660 g/mol MF: C25H29N3O2
IUPAC name: 1-[(5Z)-5-[(5Z)-5-[(5-hex-5-enyl-1H-pyrrol-2-yl)methylidene]...
Create Date: 2012-07-07
CID: 57339725

1500. Tipranavir isomer; (R-(R*,S*))-N-(3-(1-(5,6-Dihydro-4-hydroxy-2-oxo-6-(2-phenylethyl)-6-propyl-2H-pyran-3-yl)propyl)phenyl)-5-(trifluoromethyl)-2-pyridinesulfonamide; 174590-27-3 ...
MW:     602.664330 g/mol MF: C31H33F3N2O5S
IUPAC name: N-[3-[(1S)-1-[(2R)-4-hydroxy-6-oxo-2-(2-phenylethyl)-2-propy...
Create Date: 2011-12-26
CID: 54688876

1501. Tipranavir isomer; NCGC00182028-01; Tipranavir analog  14 ...
MW:     602.664330 g/mol MF: C31H33F3N2O5S
IUPAC name: N-[3-[(1R)-1-[(2S)-4-hydroxy-6-oxo-2-(2-phenylethyl)-2-propy...
Create Date: 2011-12-26
CID: 54688875

1502. Tipranavir analog  12; AC1LAQV3; SCHEMBL7401503 ...
MW:     559.675820 g/mol MF: C31H33N3O5S
IUPAC name: 5-cyano-N-[3-[(1S)-1-[(2S)-4-hydroxy-6-oxo-2-(2-phenylethyl)...
Create Date: 2011-12-26
CID: 54688874

1503. AC1LAQUX; Tipranavir analog  10; SCHEMBL7400065 ...
MW:     559.675820 g/mol MF: C31H33N3O5S
IUPAC name: 5-cyano-N-[3-[(1R)-1-[(2S)-4-hydroxy-6-oxo-2-(2-phenylethyl)...
Create Date: 2011-12-26
CID: 54688060

1504. Tipranavir enantiomer; Tipranavir analog  16; AC1L9UQL ...
MW:     602.664330 g/mol MF: C31H33F3N2O5S
IUPAC name: N-[3-[(1S)-1-[(2S)-4-hydroxy-6-oxo-2-(2-phenylethyl)-2-propy...
Create Date: 2011-12-26
CID: 54682815

1505. Tipranavir analog  13; AC1LAQW9; SCHEMBL7400567 ...
MW:     559.675820 g/mol MF: C31H33N3O5S
IUPAC name: 5-cyano-N-[3-[(1S)-1-[(2R)-4-hydroxy-6-oxo-2-(2-phenylethyl)...
Create Date: 2011-12-26
CID: 54682811

1506. Pepstatin analog, 12; BDBM59224
MW:     973.204140 g/mol MF: C53H76N6O11
IUPAC name: (2S)-2-[[(2R)-4-amino-2-[[16-[[(2R)-3-hydroxy-1-[[(2R)-1-[2-...
Create Date: 2011-09-02
CID: 53348068

1507. Pepstatin analog, 11; BDBM59223
MW:     957.204740 g/mol MF: C53H76N6O10
IUPAC name: (2S)-2-[[(2R)-4-amino-2-[[16-[[(2R)-3-hydroxy-1-[[(2R)-4-met...
Create Date: 2011-09-02
CID: 53348067

1508. Pepstatin analog, 10; BDBM59222
MW:     880.124020 g/mol MF: C47H73N7O9
IUPAC name: (2S)-2-[[(2R)-4-amino-2-[[16-[[(2R)-1-[[(2R)-1-[2-(4-aminoph...
Create Date: 2011-09-02
CID: 53348066

1509. Adenosine analog, 19; BDBM59212
MW:     323.307880 g/mol MF: C12H17N7O4
IUPAC name: 9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]...
Create Date: 2011-09-02
CID: 53348056

1510. Adenosine analog, 18; BDBM59211
MW:     310.309120 g/mol MF: C12H18N6O4
IUPAC name: (2R,3R,4S,5R)-2-[2-(aminomethyl)-6-(methylamino)purin-9-yl]-...
Create Date: 2011-09-02
CID: 53348055

1511. Adenosine analog, 15; BDBM59210
MW:     428.441760 g/mol MF: C20H24N6O5
IUPAC name: (2S,3S,4R,5R)-3,4-dihydroxy-N-(2-hydroxyethyl)-5-[6-[(2-meth...
Create Date: 2011-09-02
CID: 53348054

1512. Adenosine analog, 14; BDBM59209
MW:     427.457000 g/mol MF: C20H25N7O4
IUPAC name: (2S,3S,4R,5R)-N-(2-aminoethyl)-3,4-dihydroxy-5-[6-[(2-methyl...
Create Date: 2011-09-02
CID: 53348053

1513. Adenosine analog, 13; BDBM59208
MW:     412.442360 g/mol MF: C20H24N6O4
IUPAC name: (2S,3S,4R,5R)-N-ethyl-3,4-dihydroxy-5-[6-[(2-methylphenyl)me...
Create Date: 2011-09-02
CID: 53348052

1514. Adenosine analog, 12; BDBM59207
MW:     399.403840 g/mol MF: C18H21N7O4
IUPAC name: (2S,3S,4R,5R)-3,4-dihydroxy-5-[6-[(2-methylphenyl)methylamin...
Create Date: 2011-09-02
CID: 53348051

1515. Adenosine analog, 10; BDBM59205
MW:     365.387620 g/mol MF: C15H23N7O4
IUPAC name: (2S,3S,4R,5R)-N-(5-aminopentyl)-5-(6-aminopurin-9-yl)-3,4-di...
Create Date: 2011-09-02
CID: 53348050

1516. NBD-FTY720 analog; CTK8G1643; ZINC44676009 ...
MW:     473.522140 g/mol MF: C23H31N5O6
IUPAC name: 2-amino-2-[2-[4-[6-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]...
Create Date: 2011-05-20
CID: 52204465

1517. Filgotinib; 1206161-97-8; GLPG0634 ...
MW:     425.504020 g/mol MF: C21H23N5O3S
IUPAC name: N-[5-[4-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]phenyl]-[1,2,4...
Create Date: 2011-01-10
CID: 49831257

1518. MPI-0479605; 1246529-32-7; CHEMBL2047943 ...
MW:     407.511960 g/mol MF: C22H29N7O
IUPAC name: 6-N-cyclohexyl-2-N-(2-methyl-4-morpholin-4-ylphenyl)-7H-puri...
Create Date: 2010-10-11
CID: 46909588

1519. PSTQ Analog, 10; BDBM93356; MolPort-021-805-765 ...
MW:     384.409040 g/mol MF: C18H16N4O4S
IUPAC name: 3-(benzenesulfonyl)-5-(2-methoxyethoxy)triazolo[1,5-a]quinaz...
Create Date: 2010-09-07
CID: 46862508

1520. CHEMBL194830; Adenosine analog, 17; SCHEMBL5879766 ...
MW:     296.282540 g/mol MF: C11H16N6O4
IUPAC name: (2R,3R,4S,5R)-2-[2-amino-6-(methylamino)purin-9-yl]-5-(hydro...
Create Date: 2009-11-19
CID: 44401604

1521. Chloropeptin I analogue; CHEMBL412226; BDBM50123450
MW:    1386.845040 g/mol MF: C64H51Cl6N7O16
Create Date: 2009-11-19
CID: 44369212

1522. cyclosporin analogue 53; BDBM50119441; CID44361282 ...
MW:    1204.584060 g/mol MF: C61H109N11O13
IUPAC name: (3S,6S,9S,12R,18R,21R,24R)-30-ethyl-12-(hydroxymethyl)-33-[(...
Create Date: 2009-11-19
CID: 44361282

1523. cyclosporin analogue 56; BDBM50119411; CID44361245 ...
MW:    1176.530900 g/mol MF: C59H105N11O13
IUPAC name: (3S,9S,12R,18R,24R)-30-(1-hydroxyethyl)-33-[(E,1R,2R)-1-hydr...
Create Date: 2009-11-19
CID: 44361245

1524. cyclosporin analogue 54; BDBM50119409; CID44361227 ...
MW:    1218.610640 g/mol MF: C62H111N11O13
IUPAC name: (3S,9S,12R,18R,24R)-30-(1-hydroxyethyl)-33-[(E,1R,2R)-1-hydr...
Create Date: 2009-11-19
CID: 44361227

1525. cyclosporin analogue 55; BDBM50119439; CID44361226 ...
MW:    1248.636620 g/mol MF: C63H113N11O14
IUPAC name: (3S,9R,15R,27S,33S)-3-hydroxy-21-(1-hydroxyethyl)-24-[(E,1R,...
Create Date: 2009-11-19
CID: 44361226

1526. cyclosporin analogue 15; BDBM50119413; CID44361225 ...
MW:    1230.664400 g/mol MF: C64H115N11O12
IUPAC name: (3S,6S,9S,12R,18R,21R,24R)-33-[(E,1R,2R)-1-hydroxy-2-methylh...
Create Date: 2009-11-19
CID: 44361225

1527. cyclosporin analogue 17; BDBM50119402; CID44361223 ...
MW:    1306.760360 g/mol MF: C70H119N11O12
IUPAC name: (3S,6S,9S,12R,18R,21R,24R,27S)-27-benzyl-30-ethyl-33-[(E,1R,...
Create Date: 2009-11-19
CID: 44361223

1528. cyclosporin analogue 57; BDBM50119433; CID44361203 ...
MW:    1278.662600 g/mol MF: C64H115N11O15
IUPAC name: (3S,9R,15R,27S,33S)-24-[(E,1R,2R)-1,6-dihydroxy-2-methylhex-...
Create Date: 2009-11-19
CID: 44361203

1529. cyclosporin analogue 34; BDBM50119395; CID44361139 ...
MW:    1214.621940 g/mol MF: C63H111N11O12
IUPAC name: (6S,9S,12R,18R,21R,24R)-3-but-3-en-2-yl-30-ethyl-33-[(E,1R,2...
Create Date: 2009-11-19
CID: 44361139

1530. cyclosporin analogue 47; BDBM50119414; CID44361104 ...
MW:    1204.584060 g/mol MF: C61H109N11O13
IUPAC name: (3S,9S,12R,18R,21R,24R)-30-(1-hydroxyethyl)-33-[(E,1R,2R)-1-...
Create Date: 2009-11-19
CID: 44361104

1531. cyclosporin analogue 36; BDBM50119400; CID44361090 ...
MW:    1188.584660 g/mol MF: C61H109N11O12
IUPAC name: (3S,6S,9S,12R,18R,21R)-30-ethyl-33-[(E,1R,2R)-1-hydroxy-2-me...
Create Date: 2009-11-19
CID: 44361090

1532. cyclosporin analogue 37; BDBM50119410; CID44361089 ...
MW:    1188.584660 g/mol MF: C61H109N11O12
IUPAC name: (3S,6S,9S,12R,18R,21R)-24-butan-2-yl-30-ethyl-33-[(E,1R,2R)-...
Create Date: 2009-11-19
CID: 44361089

1533. cyclosporin analogue 58; BDBM50119420; CID44361081 ...
MW:    1248.636620 g/mol MF: C63H113N11O14
IUPAC name: (3S,9R,15R,27S,33S)-3-hydroxy-21-(1-hydroxyethyl)-24-[(E,1R,...
Create Date: 2009-11-19
CID: 44361081

1534. cyclosporin analogue 59; BDBM50119450; CID44361066 ...
MW:    1262.663200 g/mol MF: C64H115N11O14
IUPAC name: (3S,9R,15R,27S,33S)-12-butan-2-yl-3-hydroxy-21-(1-hydroxyeth...
Create Date: 2009-11-19
CID: 44361066

1535. cyclosporin analogue 60; BDBM50119401; CID44361065 ...
MW:    1248.636620 g/mol MF: C63H113N11O14
IUPAC name: (3S,9R,27S,33S)-3-hydroxy-21-(1-hydroxyethyl)-24-[(E,1R,2R)-...
Create Date: 2009-11-19
CID: 44361065

1536. cyclosporin analogue 41; BDBM50119418; CID44361057 ...
MW:    1188.584660 g/mol MF: C61H109N11O12
IUPAC name: (3S,9S,12R,18R,21R,24R)-30-ethyl-33-[(E,1R,2R)-1-hydroxy-2-m...
Create Date: 2009-11-19
CID: 44361057

1537. cyclosporin analogue 24; BDBM50119440; CID44361040 ...
MW:    1174.558080 g/mol MF: C60H107N11O12
IUPAC name: (3S,6S,9S,12R,21R,24R)-30-ethyl-33-[(E,1R,2R)-1-hydroxy-2-me...
Create Date: 2009-11-19
CID: 44361040

1538. cyclosporin analogue 25; BDBM50119422; CID44361039 ...
MW:    1230.664400 g/mol MF: C64H115N11O12
IUPAC name: (3S,6S,9S,12R,18R,21R,24R)-15,30-diethyl-33-[(E,1R,2R)-1-hyd...
Create Date: 2009-11-19
CID: 44361039

1539. cyclosporin analogue 44; BDBM50119394; CID44361033 ...
MW:    1204.584060 g/mol MF: C61H109N11O13
IUPAC name: (3S,6R,12R,15R,18R,33S)-24-(1-hydroxyethyl)-27-[(E,1R,2R)-1-...
Create Date: 2009-11-19
CID: 44361033

1540. cyclosporin analogue 40; BDBM50119430; CID44361019 ...
MW:    1174.558080 g/mol MF: C60H107N11O12
IUPAC name: (3S,9S,12R,21R,24R)-30-ethyl-33-[(E,1R,2R)-1-hydroxy-2-methy...
Create Date: 2009-11-19
CID: 44361019

1541. cyclosporin analogue 10; BDBM50119404; CID44361013 ...
MW:    1186.611840 g/mol MF: C62H111N11O11
IUPAC name: (3S,6S,9S,12R,18R,21R,24R)-33-(cyclohexylmethyl)-30-ethyl-1,...
Create Date: 2009-11-19
CID: 44361013

1542. cyclosporin analogue 28; BDBM50119419; CID44361007 ...
MW:    1214.665000 g/mol MF: C64H115N11O11
IUPAC name: (3S,6S,9S,12R,18R,24R)-1,4,7,10,12,15,19,25,28-nonamethyl-33...
Create Date: 2009-11-19
CID: 44361007

1543. cyclosporin analogue 43; BDBM50119444; CID44360998 ...
MW:    1174.558080 g/mol MF: C60H107N11O12
IUPAC name: (3S,9S,12R,18R,21R,24R)-33-[(E,1R,2R)-1-hydroxy-2-methylhex-...
Create Date: 2009-11-19
CID: 44360998

1544. cyclosporin analogue 26; BDBM50119445; CID44360989 ...
MW:    1273.732200 g/mol MF: C66H120N12O12
IUPAC name: (3S,6S,9S,12R,18R,21R,24R)-12-(4-aminobutyl)-30-ethyl-33-[(E...
Create Date: 2009-11-19
CID: 44360989

1545. cyclosporin analogue 12; BDBM50119429; CID44360963 ...
MW:    1218.610640 g/mol MF: C62H111N11O13
IUPAC name: (3S,6S,9S,12R,18R,21R,24R)-33-[(E,1R,2R)-1,6-dihydroxy-2-met...
Create Date: 2009-11-19
CID: 44360963

1546. cyclosporin analogue 13; BDBM50119451; CID44360962 ...
MW:    1202.611240 g/mol MF: C62H111N11O12
IUPAC name: (3S,6S,9S,12R,18R,21R,24R)-33-[(E,1R,2R)-1-hydroxy-2-methylh...
Create Date: 2009-11-19
CID: 44360962

1547. cyclosporin analogue 14; BDBM50119416; CID44360961 ...
MW:    1230.664400 g/mol MF: C64H115N11O12
IUPAC name: (3S,6S,9S,12R,18R,21R,24R)-33-[(E,1R,2R)-1-hydroxy-2-methylh...
Create Date: 2009-11-19
CID: 44360961

1548. cyclosporin analogue 51; BDBM50119398; CID44360943 ...
MW:    1202.611240 g/mol MF: C62H111N11O12
IUPAC name: (3S,6S,12R,18R,21R,24R)-33-[(E,1R,2R)-1-hydroxy-2-methylhex-...
Create Date: 2009-11-19
CID: 44360943

1549. cyclosporin analogue 52; BDBM50119397; CID44360931 ...
MW:    1202.611240 g/mol MF: C62H111N11O12
IUPAC name: (3S,9S,12R,18R,21R,24R)-33-[(E,1R,2R)-1-hydroxy-2-methylhex-...
Create Date: 2009-11-19
CID: 44360931

1550. cyclosporin analogue 20; BDBM50119432; CID44360926 ...
MW:    1216.637820 g/mol MF: C63H113N11O12
IUPAC name: (3S,6S,9S,12R,18R,21R)-24-butan-2-yl-30-ethyl-33-[(E,1R,2R)-...
Create Date: 2009-11-19
CID: 44360926

1551. cyclosporin analogue 21; BDBM50119412; CID44360900 ...
MW:    1232.637220 g/mol MF: C63H113N11O13
IUPAC name: (3S,6S,9S,12R,18R,21R)-30-ethyl-33-[(E,1R,2R)-1-hydroxy-2-me...
Create Date: 2009-11-19
CID: 44360900

1552. cyclosporin analogue 38; BDBM50119449; CID44360875 ...
MW:    1174.558080 g/mol MF: C60H107N11O12
IUPAC name: (3S,6S,9S,12R,18R,21R)-30-ethyl-33-[(E,1R,2R)-1-hydroxy-2-me...
Create Date: 2009-11-19
CID: 44360875

1553. cyclosporin analogue 32; BDBM50119443; CID44360866 ...
MW:    1230.664400 g/mol MF: C64H115N11O12
IUPAC name: (3S,6S,9S,12R,18R,24R)-33-[(E,1R,2R)-1-hydroxy-2-methylhex-4...
Create Date: 2009-11-19
CID: 44360866

1554. cyclosporin analogue 49; BDBM50119446; CID44360864 ...
MW:    1202.611240 g/mol MF: C62H111N11O12
IUPAC name: (3S,9S,12R,18R,21R,24R)-33-[(E,1R,2R)-1-hydroxy-2-methylhex-...
Create Date: 2009-11-19
CID: 44360864

1555. cyclosporin analogue 11; BDBM50119437; CID44360863 ...
MW:    1186.611840 g/mol MF: C62H111N11O11
IUPAC name: (3S,6S,9S,12R,15R,18R,21R,24R)-30-ethyl-1,4,7,10,12,15,19,25...
Create Date: 2009-11-19
CID: 44360863

1556. cyclosporin analogue 31; BDBM50119425; CID44360850 ...
MW:    1216.637820 g/mol MF: C63H113N11O12
IUPAC name: (3S,6S,9S,12R,18R,24R)-33-[(E,1R,2R)-1-hydroxy-2-methylhex-4...
Create Date: 2009-11-19
CID: 44360850

1557. oligoriboadenylate analog
MW:     988.582706 g/mol MF: C29H33N15O19P3-3
IUPAC name: [(5S)-5-(6-aminopurin-9-yl)-3-[[(5S)-5-(6-aminopurin-9-yl)-3...
Create Date: 2009-11-19
CID: 44295633

1558. carboline analog, 87; CHEMBL246508; SCHEMBL13248542 ...
MW:     454.545240 g/mol MF: C22H26N6O3S
IUPAC name: N-[3-(dimethylamino)propyl]-2-[(4-methyl-1-oxo-2,3,4,9-tetra...
Create Date: 2009-08-19
CID: 44143541

1559. carboline analog, 86; CHEMBL246507; SCHEMBL13248539 ...
MW:     440.518660 g/mol MF: C21H24N6O3S
IUPAC name: N-[2-(dimethylamino)ethyl]-2-[(4-methyl-1-oxo-2,3,4,9-tetrah...
Create Date: 2009-08-19
CID: 44143540

1560. carboline analog, 84; CHEMBL397642; BDBM30272
MW:     480.582520 g/mol MF: C24H28N6O3S
IUPAC name: N-[4-[4-(dimethylamino)piperidine-1-carbonyl]-1,3-thiazol-2-...
Create Date: 2009-08-19
CID: 44143539

1561. CHEMBL246300; carboline analog, 83; BDBM30271 ...
MW:     451.541300 g/mol MF: C23H25N5O3S
IUPAC name: N-cyclohexyl-2-[(4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,4...
Create Date: 2009-08-19
CID: 44143538

1562. carboline analog, 82; CHEMBL246299; BDBM30270
MW:     411.477440 g/mol MF: C20H21N5O3S
IUPAC name: 2-[(4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]indole-6-c...
Create Date: 2009-08-19
CID: 44143537

1563. carboline analog, 81; CHEMBL395932; BDBM30269
MW:     413.450260 g/mol MF: C19H19N5O4S
IUPAC name: N-(2-hydroxyethyl)-2-[(4-methyl-1-oxo-2,3,4,9-tetrahydropyri...
Create Date: 2009-08-19
CID: 44143536

1564. carboline analog, 80; CHEMBL246090; BDBM30268
MW:     440.475600 g/mol MF: C20H20N6O4S
IUPAC name: N-(3-amino-3-oxopropyl)-2-[(4-methyl-1-oxo-2,3,4,9-tetrahydr...
Create Date: 2009-08-19
CID: 44143535

1565. carboline analog, 79; CHEMBL246089; BDBM30267
MW:     426.449020 g/mol MF: C19H18N6O4S
IUPAC name: N-(2-amino-2-oxoethyl)-2-[(4-methyl-1-oxo-2,3,4,9-tetrahydro...
Create Date: 2009-08-19
CID: 44143534

1566. carboline analog, 78; CHEMBL246088; SCHEMBL13248520 ...
MW:     454.545240 g/mol MF: C22H26N6O3S
IUPAC name: N-[3-(dimethylamino)propyl]-2-[(4-methyl-1-oxo-2,3,4,9-tetra...
Create Date: 2009-08-19
CID: 44143533

1567. carboline analog, 77; CHEMBL396160; BDBM30265
MW:     412.465500 g/mol MF: C19H20N6O3S
IUPAC name: N-(2-aminoethyl)-2-[(4-methyl-1-oxo-2,3,4,9-tetrahydropyrido...
Create Date: 2009-08-19
CID: 44143532

1568. carboline analog, 76; CHEMBL245884; SCHEMBL13248511 ...
MW:     440.518660 g/mol MF: C21H24N6O3S
IUPAC name: N-[2-(dimethylamino)ethyl]-2-[(4-methyl-1-oxo-2,3,4,9-tetrah...
Create Date: 2009-08-19
CID: 44143531

1569. carboline analog, 75; CHEMBL245883; SCHEMBL13248530 ...
MW:     397.450860 g/mol MF: C19H19N5O3S
IUPAC name: N,N-dimethyl-2-[(4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,4...
Create Date: 2009-08-19
CID: 44143530

1570. carboline analog, 74; CHEMBL396159; SCHEMBL13248527 ...
MW:     383.424280 g/mol MF: C18H17N5O3S
IUPAC name: N-methyl-2-[(4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]i...
Create Date: 2009-08-19
CID: 44143529

1571. carboline analog, 73; CHEMBL245682; SCHEMBL13248537 ...
MW:     369.397700 g/mol MF: C17H15N5O3S
IUPAC name: 2-[(4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]indole-6-c...
Create Date: 2009-08-19
CID: 44143528

1572. carboline analog, 71; CHEMBL397332; SCHEMBL13248504 ...
MW:     369.397700 g/mol MF: C17H15N5O3S
IUPAC name: 2-[(4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]indole-6-c...
Create Date: 2009-08-19
CID: 44143527

1573. carboline analog, 69; CHEMBL247333; SCHEMBL13248489 ...
MW:     363.369980 g/mol MF: C19H17N5O3
IUPAC name: N-(6-carbamoylpyridin-3-yl)-4-methyl-1-oxo-2,3,4,9-tetrahydr...
Create Date: 2009-08-19
CID: 44143526

1574. carboline analog, 68; CHEMBL394926; SCHEMBL2998939 ...
MW:     378.381320 g/mol MF: C20H18N4O4
IUPAC name: methyl 5-[(4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]ind...
Create Date: 2009-08-19
CID: 44143525

1575. carboline analog, 66; CHEMBL397388; SCHEMBL13248439 ...
MW:     376.408500 g/mol MF: C21H20N4O3
IUPAC name: N-(4-acetamidophenyl)-4-methyl-1-oxo-2,3,4,9-tetrahydropyrid...
Create Date: 2009-08-19
CID: 44143524

1576. carboline analog, 65; CHEMBL246082; SCHEMBL2995986 ...
MW:     377.393260 g/mol MF: C21H19N3O4
IUPAC name: methyl 4-[(4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]ind...
Create Date: 2009-08-19
CID: 44143523

1577. carboline analog, 56; CHEMBL248333; SCHEMBL13248438 ...
MW:     376.408500 g/mol MF: C21H20N4O3
IUPAC name: N-(3-acetamidophenyl)-4-methyl-1-oxo-2,3,4,9-tetrahydropyrid...
Create Date: 2009-08-19
CID: 44143522

1578. carboline analog, 51; CHEMBL246697; SCHEMBL13248441 ...
MW:     337.347643 g/mol MF: C19H16FN3O2
IUPAC name: N-(3-fluorophenyl)-4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3...
Create Date: 2009-08-19
CID: 44143521

1579. carboline analog, 47; CHEMBL391983; SCHEMBL13248420 ...
MW:     362.381920 g/mol MF: C20H18N4O3
IUPAC name: N-(2-carbamoylphenyl)-4-methyl-1-oxo-2,3,4,9-tetrahydropyrid...
Create Date: 2009-08-19
CID: 44143520

1580. carboline analog, 39; CHEMBL246480; SCHEMBL2996220 ...
MW:     321.333300 g/mol MF: C17H15N5O2
IUPAC name: 4-methyl-1-oxo-N-pyrimidin-4-yl-2,3,4,9-tetrahydropyrido[3,4...
Create Date: 2009-08-19
CID: 44143519

1581. carboline analog, 34; CHEMBL247306; BDBM30222
MW:     347.410340 g/mol MF: C21H21N3O2
IUPAC name: 4-methyl-1-oxo-N-(2-phenylethyl)-2,3,4,9-tetrahydropyrido[3,...
Create Date: 2009-08-19
CID: 44143518

1582. carboline analog, 33; CHEMBL247305; BDBM30221
MW:     333.383760 g/mol MF: C20H19N3O2
IUPAC name: N-benzyl-4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]indol...
Create Date: 2009-08-19
CID: 44143517

1583. carboline analog, 31; CHEMBL247095; BDBM30219
MW:     311.378240 g/mol MF: C18H21N3O2
IUPAC name: 4-methyl-6-(piperidine-1-carbonyl)-2,3,4,9-tetrahydropyrido[...
Create Date: 2009-08-19
CID: 44143516

1584. carboline analog, 30; CHEMBL246894; BDBM30218
MW:     325.404820 g/mol MF: C19H23N3O2
IUPAC name: N-cyclohexyl-4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]i...
Create Date: 2009-08-19
CID: 44143515

1585. carboline analog, 29; CHEMBL246893; BDBM30217
MW:     271.314380 g/mol MF: C15H17N3O2
IUPAC name: N,N,4-trimethyl-1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]indole-...
Create Date: 2009-08-19
CID: 44143514

1586. carboline analog, 27; CHEMBL246892; BDBM30215
MW:     243.261220 g/mol MF: C13H13N3O2
IUPAC name: 4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]indole-6-carbo...
Create Date: 2009-08-19
CID: 44143513

1587. carboline analog, 26; CHEMBL246891; BDBM30214
MW:     257.287800 g/mol MF: C14H15N3O2
IUPAC name: N-(4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]indol-6-yl)...
Create Date: 2009-08-19
CID: 44143512

1588. carboline analog, 25; CHEMBL248104; BDBM30213
MW:     306.358420 g/mol MF: C19H18N2O2
IUPAC name: 4-methyl-6-phenylmethoxy-2,3,4,9-tetrahydropyrido[3,4-b]indo...
Create Date: 2009-08-19
CID: 44143511

1589. carboline analog, 24; CHEMBL247907; BDBM30211
MW:     216.235880 g/mol MF: C12H12N2O2
IUPAC name: 6-hydroxy-4-methyl-2,3,4,9-tetrahydropyrido[3,4-b]indol-1-on...
Create Date: 2009-08-19
CID: 44143510

1590. carboline analog, 23; CHEMBL394494; BDBM30210 ...
MW:     279.132540 g/mol MF: C12H11BrN2O
IUPAC name: 6-bromo-4-methyl-2,3,4,9-tetrahydropyrido[3,4-b]indol-1-one
Create Date: 2009-08-19
CID: 44143509

1591. carboline analog, 22; CHEMBL247906; BDBM30209
MW:     276.332440 g/mol MF: C18H16N2O
IUPAC name: 4-methyl-6-phenyl-2,3,4,9-tetrahydropyrido[3,4-b]indol-1-one
Create Date: 2009-08-19
CID: 44143508

1592. carboline analog, 21; CHEMBL394493; BDBM30208
MW:     214.263060 g/mol MF: C13H14N2O
IUPAC name: 4,6-dimethyl-2,3,4,9-tetrahydropyrido[3,4-b]indol-1-one
Create Date: 2009-08-19
CID: 44143507

1593. carboline analog, 20; CHEMBL247905; BDBM30207 ...
MW:     200.236480 g/mol MF: C12H12N2O
IUPAC name: 4-methyl-2,3,4,9-tetrahydropyrido[3,4-b]indol-1-one
Create Date: 2009-08-19
CID: 44143506

1594. cambinol analog, 6viii; CHEMBL521948; BDBM29052
MW:     439.325000 g/mol MF: C21H15BrN2O2S
IUPAC name: 6-(3-bromophenyl)-5-[(2-hydroxynaphthalen-1-yl)methyl]-2-sul...
Create Date: 2009-06-25
CID: 42617966

1595. Glutamine Analogue, 1; BDBM93009
MW:     146.144500 g/mol MF: C5H10N2O3
IUPAC name: 5-amino-2-azaniumyl-5-oxopentanoate
Create Date: 2009-05-14
CID: 25244553

1596. Peptide analogue, 26; CHEMBL507796; BDBM26348 ...
MW:     798.905443 g/mol MF: C41H51FN10O6
IUPAC name: N-[(2S)-1-[[2-[[(2R)-1-[[(2S)-1-[[(2S)-1-amino-3-(1H-indol-3...
Create Date: 2009-01-30
CID: 25138132

1597. Peptide analogue, 25b; CHEMBL453956; BDBM26347 ...
MW:     799.933263 g/mol MF: C42H54FN9O6
IUPAC name: N-[(2S)-1-[[(2S,4R)-4-[[(2S)-1-[[(2S)-1-amino-3-(1H-indol-3-...
Create Date: 2009-01-30
CID: 25138131

1598. Peptide analogue, 25a; CHEMBL450923; BDBM26346 ...
MW:     799.933263 g/mol MF: C42H54FN9O6
IUPAC name: N-[(2S)-1-[[(2S,4S)-4-[[(2S)-1-[[(2S)-1-amino-3-(1H-indol-3-...
Create Date: 2009-01-30
CID: 25138130

1599. Peptide analogue, 24b; CHEMBL503052; BDBM26345 ...
MW:     799.933263 g/mol MF: C42H54FN9O6
IUPAC name: N-[(2S)-1-[[(2R,4R)-4-[[(2S)-1-[[(2S)-1-amino-3-(1H-indol-3-...
Create Date: 2009-01-30
CID: 25138129

1600. Peptide analogue, 24a; CHEMBL478053; BDBM26344 ...
MW:     799.933263 g/mol MF: C42H54FN9O6
IUPAC name: N-[(2S)-1-[[(2R,4S)-4-[[(2S)-1-[[(2S)-1-amino-3-(1H-indol-3-...
Create Date: 2009-01-30
CID: 25138128

1601. Peptide analogue, 23; CHEMBL444522; SCHEMBL12891669 ...
MW:     797.917383 g/mol MF: C42H52FN9O6
IUPAC name: N-[(2S)-1-[[(E,2S)-4-[[(2S)-1-[[(2S)-1-amino-3-(1H-indol-3-y...
Create Date: 2009-01-30
CID: 25138127

1602. Peptide analogue, 22; CHEMBL448207; SCHEMBL12891668 ...
MW:     797.917383 g/mol MF: C42H52FN9O6
IUPAC name: N-[(2S)-1-[[(E,2R)-4-[[(2S)-1-[[(2S)-1-amino-3-(1H-indol-3-y...
Create Date: 2009-01-30
CID: 25138126

1603. Peptide analogue, 21; CHEMBL501043; SCHEMBL12891665 ...
MW:     781.917983 g/mol MF: C42H52FN9O5
IUPAC name: N-[(2S)-1-[[(E)-4-[[(2S)-1-[[(2S)-1-amino-3-(1H-indol-3-yl)-...
Create Date: 2009-01-30
CID: 25138125

1604. Peptide analogue, 20; CHEMBL444664; SCHEMBL12891664 ...
MW:     783.933863 g/mol MF: C42H54FN9O5
IUPAC name: N-[(2S)-1-[[(4S)-4-[[(2S)-1-[[(2S)-1-amino-3-(1H-indol-3-yl)...
Create Date: 2009-01-30
CID: 25138124

1605. Peptide analogue, 19; CHEMBL472833; SCHEMBL12891663 ...
MW:     781.917983 g/mol MF: C42H52FN9O5
IUPAC name: N-[(2S)-1-[[(E,4R)-4-[[(2S)-1-[[(2S)-1-amino-3-(1H-indol-3-y...
Create Date: 2009-01-30
CID: 25138123

1606. bipyridine analogue, 7; SCHEMBL2868531; CHEMBL3108956 ...
MW:     258.229500 g/mol MF: C13H10N2O4
IUPAC name: 2-(4-methoxycarbonylpyridin-2-yl)pyridine-4-carboxylic acid
Create Date: 2009-01-30
CID: 25138011

1607. Conessine analogue, 9; CHEMBL488891; SCHEMBL14184316 ...
MW:     517.959060 g/mol MF: C26H39Cl3N2O2
Create Date: 2008-11-24
CID: 25053422

1608. CHEMBL248486; phenyl analogue, 35g; BDBM25186 ...
MW:     313.314830 g/mol MF: C16H18F3NO2
IUPAC name: N-(cyclohexylmethyl)-4-(2,2,2-trifluoroacetyl)benzamide
Create Date: 2008-11-14
CID: 25023822

1609. phenyl analogue, 34g; CHEMBL493785; BDBM25185 ...
MW:     313.314830 g/mol MF: C16H18F3NO2
IUPAC name: N-(cyclohexylmethyl)-3-(2,2,2-trifluoroacetyl)benzamide
Create Date: 2008-11-14
CID: 25023821

1610. Thiazole analogue, 10; CHEMBL487850; BDBM24523 ...
MW:     467.603600 g/mol MF: C24H25N3O3S2
IUPAC name: (5E)-2-[[4-(1-adamantyl)-1,3-thiazol-2-yl]amino]-5-[(4-hydro...
Create Date: 2008-10-21
CID: 24971242

1611. Amino acid analog, 4g; CHEMBL478534; BDBM24257 ...
MW:     328.362400 g/mol MF: C18H20N2O4
IUPAC name: (2R)-2-amino-5-oxo-5-(4-phenylmethoxyanilino)pentanoic acid
Create Date: 2008-09-22
CID: 24901604

1612. Amino acid analog, 4e; CHEMBL517209; BDBM24255 ...
MW:     314.335820 g/mol MF: C17H18N2O4
IUPAC name: (2S)-2-amino-4-oxo-4-(4-phenylmethoxyanilino)butanoic acid
Create Date: 2008-09-22
CID: 24901603

1613. Amino acid analog, 4d; CHEMBL478360; BDBM24254 ...
MW:     314.335820 g/mol MF: C17H18N2O4
IUPAC name: (3R)-3-amino-4-oxo-4-(4-phenylmethoxyanilino)butanoic acid
Create Date: 2008-09-22
CID: 24901602

1614. Amino acid analog, 4c; CHEMBL477478; BDBM24253 ...
MW:     328.362400 g/mol MF: C18H20N2O4
IUPAC name: (4R)-4-amino-5-oxo-5-(4-phenylmethoxyanilino)pentanoic acid
Create Date: 2008-09-22
CID: 24901601

1615. Amino acid analog, 4a; CHEMBL478550; BDBM24251 ...
MW:     328.362400 g/mol MF: C18H20N2O4
IUPAC name: (4S)-4-amino-5-oxo-5-(4-phenylmethoxyanilino)pentanoic acid
Create Date: 2008-09-22
CID: 24901600

1616. Amino acid analog, 3g; CHEMBL517049; BDBM24250 ...
MW:     327.420700 g/mol MF: C19H25N3O2
IUPAC name: (2S)-2,6-diamino-N-(4-phenylmethoxyphenyl)hexanamide
Create Date: 2008-09-22
CID: 24901599

1617. Amino acid analog, 3f; CHEMBL477308; BDBM24249 ...
MW:     336.387700 g/mol MF: C19H20N4O2
IUPAC name: (2S)-2-amino-3-(1H-imidazol-5-yl)-N-(4-phenylmethoxyphenyl)p...
Create Date: 2008-09-22
CID: 24901598

1618. Amino acid analog, 3e; CHEMBL478343; BDBM24248
MW:     327.377640 g/mol MF: C18H21N3O3
IUPAC name: (2S)-2-amino-N-(4-phenylmethoxyphenyl)pentanediamide
Create Date: 2008-09-22
CID: 24901597

1619. Amino acid analog, 3b; CHEMBL505728; BDBM24245 ...
MW:     312.406060 g/mol MF: C19H24N2O2
IUPAC name: (2S,3S)-2-amino-3-methyl-N-(4-phenylmethoxyphenyl)pentanamid...
Create Date: 2008-09-22
CID: 24901596

1620. Benzyl Analog of Taxol; MLS001097690; CHEMBL1354927 ...
MW:     867.932720 g/mol MF: C48H53NO14
Create Date: 2008-05-20
CID: 24791031

1621. Nucleoside analogue, 4; CHEMBL251639; BDBM21956 ...
MW:     283.240720 g/mol MF: C10H13N5O5
IUPAC name: 4-amino-3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxol...
Create Date: 2008-05-08
CID: 24776419

1622. Nucleoside analogue, 2; CHEMBL251638; BDBM21954 ...
MW:     267.241320 g/mol MF: C10H13N5O4
IUPAC name: 4-amino-3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl...
Create Date: 2008-05-08
CID: 24776418

1623. (2S)-2-amino-4-{[4-(benzyloxy)phenyl]carbamoyl}butanoic acid; Amino acid analog, 4f; CHEMBL478381 ...
MW:     328.362400 g/mol MF: C18H20N2O4
IUPAC name: (2S)-2-amino-5-oxo-5-(4-phenylmethoxyanilino)pentanoic acid
Create Date: 2008-04-23
CID: 24768560

1624. Amino acid analog, 4b; CHEMBL477307; BDBM24252 ...
MW:     314.335820 g/mol MF: C17H18N2O4
IUPAC name: (3S)-3-amino-4-oxo-4-(4-phenylmethoxyanilino)butanoic acid
Create Date: 2008-04-23
CID: 24768559

1625. thiourea analogue, 19; CHEMBL390608; SCHEMBL5947662 ...
MW:     437.594323 g/mol MF: C21H28FN3O2S2
IUPAC name: 1-[(4-tert-butylphenyl)methyl]-3-[(1S)-1-[3-fluoro-4-(methan...
Create Date: 2008-04-23
CID: 24768196

1626. thiourea analogue, 18; CHEMBL228416; SCHEMBL5947557 ...
MW:     437.594323 g/mol MF: C21H28FN3O2S2
IUPAC name: 1-[(4-tert-butylphenyl)methyl]-3-[(1R)-1-[3-fluoro-4-(methan...
Create Date: 2008-04-23
CID: 24768195

1627. thiourea analogue, 15; CHEMBL433276; SCHEMBL5947863 ...
MW:     419.603860 g/mol MF: C21H29N3O2S2
IUPAC name: 1-[(4-tert-butylphenyl)methyl]-3-[(1S)-1-[4-(methanesulfonam...
Create Date: 2008-04-23
CID: 24768194

1628. CHEMBL246301; carboline analog, 85; BDBM30273 ...
MW:     466.555940 g/mol MF: C23H26N6O3S
IUPAC name: 2-[(4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]indole-6-c...
Create Date: 2008-02-04
CID: 23661566

1629. ethanol analogue, 37; CHEMBL226096; SCHEMBL1124767 ...
MW:     526.548310 g/mol MF: C32H25F3N2O2
IUPAC name: [4-[3-[[4-(2-hydroxyethyl)phenyl]methylamino]phenyl]-8-(trif...
Create Date: 2008-01-19
CID: 23648485

1630. Arzoxifene analogue, 3; F-DMA; CHEMBL226269 ...
MW:     463.563643 g/mol MF: C27H26FNO3S
IUPAC name: 2-(4-fluorophenyl)-3-[4-(2-piperidin-1-ylethoxy)phenoxy]-1-b...
Create Date: 2008-01-19
CID: 23648275

1631. sulfanimide analog, 9n; BDBM16932; 5-{5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]pyridin-3-yl}-1,3-dihydro-2$l;{6},1,3-benzothiadiazole-2,2-dione
MW:     435.498840 g/mol MF: C22H21N5O3S
IUPAC name: (2S)-1-[5-(2,2-dioxo-1,3-dihydro-2$l^{6},1,3-benzothiadiazol...
Create Date: 2008-01-19
CID: 23647549

1632. 5-azaindole analog 33; BDBM14895; N-{[3-(2-hydroxy-3-{1H-pyrrolo[3,2-c]pyridin-2-yl}phenyl)phenyl]methyl}-4-phenylbutanamide
MW:     461.554280 g/mol MF: C30H27N3O2
IUPAC name: N-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyridin-2-yl)phenyl]phe...
Create Date: 2008-01-19
CID: 23646882

1633. 5-azaindole analog 9; CHEMBL446441; BDBM14871 ...
MW:     452.479643 g/mol MF: C27H21FN4O2
IUPAC name: 1-(4-fluorophenyl)-3-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyri...
Create Date: 2008-01-19
CID: 23646859

1634. 5-azaindole analog 8; CHEMBL382703; BDBM14870 ...
MW:     452.479643 g/mol MF: C27H21FN4O2
IUPAC name: 1-(3-fluorophenyl)-3-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyri...
Create Date: 2008-01-19
CID: 23646858

1635. 5-azaindole analog 7; CHEMBL210677; BDBM14869 ...
MW:     452.479643 g/mol MF: C27H21FN4O2
IUPAC name: 1-(2-fluorophenyl)-3-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyri...
Create Date: 2008-01-19
CID: 23646857

1636. 5-azaindole analog 6; CHEMBL209979; BDBM14868 ...
MW:     434.489180 g/mol MF: C27H22N4O2
IUPAC name: 1-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyridin-2-yl)phenyl]phe...
Create Date: 2008-01-19
CID: 23646856

1637. 5-azaindole analog 5; CHEMBL208670; BDBM14867 ...
MW:     468.570060 g/mol MF: C27H24N4O2S
IUPAC name: 1-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyridin-2-yl)phenyl]phe...
Create Date: 2008-01-19
CID: 23646855

1638. 5-azaindole analog 4; CHEMBL208702; BDBM14866 ...
MW:     462.542340 g/mol MF: C29H26N4O2
IUPAC name: 1-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyridin-2-yl)phenyl]phe...
Create Date: 2008-01-19
CID: 23646854

1639. 5-azaindole analog 3; CHEMBL208701; BDBM14865 ...
MW:     428.526120 g/mol MF: C26H28N4O2
IUPAC name: 1-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyridin-2-yl)phenyl]phe...
Create Date: 2008-01-19
CID: 23646853

1640. 2-quinolone analog 3c; CHEMBL373267; BDBM14444 ...
MW:     480.944940 g/mol MF: C28H21ClN4O2
IUPAC name: 4-[[3-[[4-(3-chlorophenyl)-1-methyl-2-oxoquinolin-6-yl]methy...
Create Date: 2008-01-19
CID: 23646770

1641. 2-quinolone analog 3b; CHEMBL425561; BDBM14443 ...
MW:     522.981620 g/mol MF: C30H23ClN4O3
IUPAC name: [[3-[[4-(3-chlorophenyl)-1-methyl-2-oxoquinolin-6-yl]methyl]...
Create Date: 2008-01-19
CID: 23646769

1642. 2-quinolone analog 3a; CHEMBL194143; BDBM14439 ...
MW:     464.945540 g/mol MF: C28H21ClN4O
IUPAC name: 4-[[3-[[4-(3-chlorophenyl)-1-methyl-2-oxoquinolin-6-yl]methy...
Create Date: 2008-01-19
CID: 23646765

1643. 2-quinolone analog 2d; CHEMBL365362; BDBM14438 ...
MW:     507.970280 g/mol MF: C29H22ClN5O2
IUPAC name: N-[[4-(3-chlorophenyl)-1-methyl-2-oxoquinolin-6-yl]-[3-[(4-c...
Create Date: 2008-01-19
CID: 23646764

1644. 2-quinolone analog 2c; CHEMBL194041; BDBM14437 ...
MW:     479.960180 g/mol MF: C28H22ClN5O
IUPAC name: 4-[[5-[amino-[4-(3-chlorophenyl)-1-methyl-2-oxoquinolin-6-yl...
Create Date: 2008-01-19
CID: 23646763

1645. 2-quinolone analog 2b; CHEMBL194172; BDBM14436 ...
MW:     478.929060 g/mol MF: C28H19ClN4O2
IUPAC name: 4-[[5-[4-(3-chlorophenyl)-1-methyl-2-oxoquinoline-6-carbonyl...
Create Date: 2008-01-19
CID: 23646762

1646. Diazepanone Analog 26; SCHEMBL5034053; BDBM13528 ...
MW:     409.405490 g/mol MF: C19H22F3N5O2
IUPAC name: (3R)-4-[(3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-3-(p...
Create Date: 2008-01-19
CID: 23646452

1647. Diazepanone Analog 25; CHEMBL216178; BDBM13527 ...
MW:     420.428130 g/mol MF: C21H23F3N4O2
IUPAC name: (3R)-4-[(3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-3-(p...
Create Date: 2008-01-19
CID: 23646451

1648. Diazepanone Analog 24; CHEMBL386380; BDBM13526 ...
MW:     419.440070 g/mol MF: C22H24F3N3O2
IUPAC name: (3R)-4-[(3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-3-be...
Create Date: 2008-01-19
CID: 23646450

1649. Diazepanone Analog 23; CHEMBL218459; BDBM13524 ...
MW:     357.370690 g/mol MF: C17H22F3N3O2
IUPAC name: (3R)-4-[(3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-3-et...
Create Date: 2008-01-19
CID: 23646449

1650. Diazepanone Analog 22; 1,4-diazepan-2-one 2c; CHEMBL216643 ...
MW:     329.317530 g/mol MF: C15H18F3N3O2
IUPAC name: 4-[(3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-1,4-diaze...
Create Date: 2008-01-19
CID: 23646448

1651. Diazepanone Analog 21; CHEMBL384382; BDBM13522 ...
MW:     343.344110 g/mol MF: C16H20F3N3O2
IUPAC name: (3R)-4-[(3S)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-3-me...
Create Date: 2008-01-19
CID: 23646447

1652. Diazepanone Analog 20; CHEMBL216234; BDBM13521 ...
MW:     343.344110 g/mol MF: C16H20F3N3O2
IUPAC name: (3S)-4-[(3S)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-3-me...
Create Date: 2008-01-19
CID: 23646446

1653. Diazepanone Analog 19; CHEMBL217005; BDBM13520 ...
MW:     343.344110 g/mol MF: C16H20F3N3O2
IUPAC name: (3S)-4-[(3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-3-me...
Create Date: 2008-01-19
CID: 23646445

1654. Diazepanone Analog 17; 1,4-diazepan-2-one 2a; CHEMBL217016 ...
MW:     325.353646 g/mol MF: C16H21F2N3O2
IUPAC name: (3R)-4-[(3R)-3-amino-4-(2,5-difluorophenyl)butanoyl]-3-methy...
Create Date: 2008-01-19
CID: 23646444

1655. Imidazolone Analog 15; CHEMBL384816; BDBM13516 ...
MW:     297.300486 g/mol MF: C14H17F2N3O2
IUPAC name: (5R)-1-[(3R)-3-amino-4-(2,5-difluorophenyl)butanoyl]-5-methy...
Create Date: 2008-01-19
CID: 23646442

1656. Sitagliptin Analog 14; CHEMBL217051; BDBM13515 ...
MW:     403.349736 g/mol MF: C17H18F5N5O
IUPAC name: (3R)-3-amino-4-(2,5-difluorophenyl)-1-[(8R)-8-methyl-3-(trif...
Create Date: 2008-01-19
CID: 23646441

1657. 3-(1-(Dimethylamino)ethyl)phenyl dimethylcarbamate; 25081-93-0; 3-[1-(dimethylamino)ethyl]phenyl N,N-dimethylcarbamate ...
MW:     236.310100 g/mol MF: C13H20N2O2
IUPAC name: [3-[1-(dimethylamino)ethyl]phenyl] N,N-dimethylcarbamate
Create Date: 2008-01-19
CID: 23645310

1658. GW113 analog 16; BDBM8947; 6,7-dihydroxy-2-(1H-imidazol-5-ylmethyl)-3,4-dihydro-2H-naphthalen-1-one ...
MW:     258.272560 g/mol MF: C14H14N2O3
IUPAC name: 6,7-dihydroxy-2-(1H-imidazol-5-ylmethyl)-3,4-dihydro-2H-naph...
Create Date: 2008-01-19
CID: 23644759

1659. BW19 analog 15; BDBM8946; 3,4-Dihydro-2-(5-imidazolyl)-6,7-dimethoxy-1-methyl-naphthalene ...
MW:     284.352900 g/mol MF: C17H20N2O2
IUPAC name: 5-[(6,7-dimethoxy-1-methyl-3,4-dihydronaphthalen-2-yl)methyl...
Create Date: 2008-01-19
CID: 23644758

1660. GW113 analog 14; BDBM8945; 7-hydroxy-2-(1H-imidazol-5-ylmethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-one ...
MW:     272.299140 g/mol MF: C15H16N2O3
IUPAC name: 7-hydroxy-2-(1H-imidazol-5-ylmethyl)-6-methoxy-3,4-dihydro-2...
Create Date: 2008-01-19
CID: 23644757

1661. GW113 analog 13; BDBM8944; 2-(1H-imidazol-5-ylmethyl)-6,7-dimethoxy-3,4-dihydro-2H-naphthalen-1-one ...
MW:     286.325720 g/mol MF: C16H18N2O3
IUPAC name: 2-(1H-imidazol-5-ylmethyl)-6,7-dimethoxy-3,4-dihydro-2H-naph...
Create Date: 2008-01-19
CID: 23644756

1662. GW93 analog 12; BDBM8943; 7-Hydroxy-2-(1H-imidazol-5-ylmethylene)-6-methoxy-3,4-dihydro-2H-naphthalen-1-one ...
MW:     270.283260 g/mol MF: C15H14N2O3
IUPAC name: (2E)-7-hydroxy-2-(1H-imidazol-5-ylmethylidene)-6-methoxy-3,4...
Create Date: 2008-01-19
CID: 23644755

1663. GW93 analog 11; BDBM8942; (2E)-2-(1H-imidazol-5-ylmethylidene)-6,7-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-one ...
MW:     284.309840 g/mol MF: C16H16N2O3
IUPAC name: (2E)-2-(1H-imidazol-5-ylmethylidene)-6,7-dimethoxy-3,4-dihyd...
Create Date: 2008-01-19
CID: 23644754

1664. Compound 2 analog 23; BDBM11312; 2-(4,5-dihydro-1,3-thiazol-2-yl)-1-(1,3-thiazol-2-yl)ethan-1-one
MW:     212.291920 g/mol MF: C8H8N2OS2
IUPAC name: 2-(4,5-dihydro-1,3-thiazol-2-yl)-1-(1,3-thiazol-2-yl)ethanon...
Create Date: 2008-01-19
CID: 23644661

1665. GW93 analog 10; BDBM8941; 6-Hydroxy-2-(1H-imidazol-5-ylmethylene)-3,4-dihydro-2H-naphthalen-1-one ...
MW:     240.257280 g/mol MF: C14H12N2O2
IUPAC name: (2E)-6-hydroxy-2-(1H-imidazol-5-ylmethylidene)-3,4-dihydrona...
Create Date: 2008-01-19
CID: 23644604

1666. Amino acid analog, 3d; CHEMBL478342; BDBM24247 ...
MW:     296.363600 g/mol MF: C18H20N2O2
IUPAC name: (2S)-N-(4-phenylmethoxyphenyl)pyrrolidine-2-carboxamide
Create Date: 2007-12-05
CID: 22691428

1667. Amino acid analog, 3c; CHEMBL516896; BDBM24246 ...
MW:     346.422280 g/mol MF: C22H22N2O2
IUPAC name: (2S)-2-amino-3-phenyl-N-(4-phenylmethoxyphenyl)propanamide
Create Date: 2007-12-05
CID: 22691264

1668. Amino acid analog, 3a; CHEMBL508881; BDBM24244 ...
MW:     270.326320 g/mol MF: C16H18N2O2
IUPAC name: (2S)-2-amino-N-(4-phenylmethoxyphenyl)propanamide
Create Date: 2007-12-05
CID: 22690542

1669. N-[4-(benzyloxy)phenyl]glycinamide; CHEMBL479960; Amino acid analog, 2 ...
MW:     256.299740 g/mol MF: C15H16N2O2
IUPAC name: 2-amino-N-(4-phenylmethoxyphenyl)acetamide
Create Date: 2007-12-05
CID: 22690393

1670. Phosphate analogue, 9; SCHEMBL7920076; BDBM84558
MW:     181.126842 g/mol MF: C5H12NO4P
IUPAC name: 3-acetamidopropylphosphonic acid
Create Date: 2007-12-05
CID: 21180953

1671. pyridine analogue, 47; CHEMBL508403; SCHEMBL4810698 ...
MW:     424.426483 g/mol MF: C25H17FN4O2
IUPAC name: N-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]-6-ph...
Create Date: 2007-12-05
CID: 21081778

1672. carboline analog, 17; CHEMBL246526; SCHEMBL9671683 ...
MW:     230.262460 g/mol MF: C13H14N2O2
IUPAC name: 6-methoxy-4-methyl-2,3,4,9-tetrahydropyrido[3,4-b]indol-1-on...
Create Date: 2007-12-05
CID: 20066922

1673. Nucleoside analogue, 1; CHEMBL251637; BDBM21953 ...
MW:     267.241320 g/mol MF: C10H13N5O4
IUPAC name: 4-amino-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl...
Create Date: 2007-09-14
CID: 16728337

1674. Arzoxifene analogue, 4; CHEMBL389683; SCHEMBL17154284 ...
MW:     524.469240 g/mol MF: C27H26BrNO3S
IUPAC name: 2-(4-bromophenyl)-3-[4-(2-piperidin-1-ylethoxy)phenoxy]-1-be...
Create Date: 2007-08-27
CID: 16720250

1675. Pladienolide analog 10; BDBM36362; CID1620213
MW:    1175.402110 g/mol MF: C58H85F3N8O12S
IUPAC name: [(2S,3S,4E,6S,7R,10R)-7,10-dihydroxy-2-[(2E,4E,6S)-7-[(2R,3R...
Create Date: 2007-07-09
CID: 16202135

1676. Neuropeptide Y analogue; BDBM50281779; AKOS004902739
MW:    2220.577680 g/mol MF: C102H162N32O24
Create Date: 2007-07-03
CID: 16131943

1677. pyridylfuran analog 15; BDBM9097; CHEMBL381630 ...
MW:     825.272270 g/mol MF: C41H44ClF3N6O7
IUPAC name: (2S)-4-[2-[5-(4-chlorophenyl)-1,3-oxazol-2-yl]propan-2-yl]-1...
Create Date: 2007-03-08
CID: 15955613

1678. carboline analog, 59; CHEMBL248335; SCHEMBL13248378 ...
MW:     361.436920 g/mol MF: C22H23N3O2
IUPAC name: 4-methyl-1-oxo-N-(4-propan-2-ylphenyl)-2,3,4,9-tetrahydropyr...
Create Date: 2007-03-07
CID: 15952934

1679. carboline analog, 58; CHEMBL248533; SCHEMBL2996216 ...
MW:     333.383760 g/mol MF: C20H19N3O2
IUPAC name: 4-methyl-N-(4-methylphenyl)-1-oxo-2,3,4,9-tetrahydropyrido[3...
Create Date: 2007-03-07
CID: 15952933

1680. carboline analog, 28; CHEMBL393056; SCHEMBL3000887 ...
MW:     257.287800 g/mol MF: C14H15N3O2
IUPAC name: N,4-dimethyl-1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]indole-6-c...
Create Date: 2007-03-07
CID: 15952827

1681. carboline analog, 32; CHEMBL393057; SCHEMBL2994730 ...
MW:     319.357180 g/mol MF: C19H17N3O2
IUPAC name: 4-methyl-1-oxo-N-phenyl-2,3,4,9-tetrahydropyrido[3,4-b]indol...
Create Date: 2007-03-07
CID: 15952825

1682. carboline analog, 72; CHEMBL245680; SCHEMBL2990252 ...
MW:     384.409040 g/mol MF: C18H16N4O4S
IUPAC name: methyl 2-[(4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]ind...
Create Date: 2007-03-07
CID: 15952436

1683. carboline analog, 70; CHEMBL245485; SCHEMBL2998003 ...
MW:     384.409040 g/mol MF: C18H16N4O4S
IUPAC name: methyl 2-[(4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]ind...
Create Date: 2007-03-07
CID: 15952435

1684. carboline analog, 43; CHEMBL246482; SCHEMBL2990198 ...
MW:     333.383760 g/mol MF: C20H19N3O2
IUPAC name: 4-methyl-N-(2-methylphenyl)-1-oxo-2,3,4,9-tetrahydropyrido[3...
Create Date: 2007-03-07
CID: 15952341

1685. carboline analog, 45; CHEMBL246695; SCHEMBL13248469 ...
MW:     398.253240 g/mol MF: C19H16BrN3O2
IUPAC name: N-(2-bromophenyl)-4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,...
Create Date: 2007-03-07
CID: 15952340

1686. carboline analog, 49; CHEMBL246907; SCHEMBL13248458 ...
MW:     361.436920 g/mol MF: C22H23N3O2
IUPAC name: 4-methyl-1-oxo-N-(3-propan-2-ylphenyl)-2,3,4,9-tetrahydropyr...
Create Date: 2007-03-07
CID: 15952246

1687. carboline analog, 50; CHEMBL246696; SCHEMBL13248456 ...
MW:     375.463500 g/mol MF: C23H25N3O2
IUPAC name: N-(3-tert-butylphenyl)-4-methyl-1-oxo-2,3,4,9-tetrahydropyri...
Create Date: 2007-03-07
CID: 15952243

1688. carboline analog, 42; CHEMBL392597; SCHEMBL2997879 ...
MW:     376.431640 g/mol MF: C20H16N4O2S
IUPAC name: N-(1,3-benzothiazol-2-yl)-4-methyl-1-oxo-2,3,4,9-tetrahydrop...
Create Date: 2007-03-07
CID: 15952155

1689. carboline analog, 41; CHEMBL246481; SCHEMBL2993727 ...
MW:     321.333300 g/mol MF: C17H15N5O2
IUPAC name: 4-methyl-1-oxo-N-pyrimidin-2-yl-2,3,4,9-tetrahydropyrido[3,4...
Create Date: 2007-03-07
CID: 15952154

1690. carboline analog, 44; CHEMBL394262; SCHEMBL13248448 ...
MW:     337.347643 g/mol MF: C19H16FN3O2
IUPAC name: N-(2-fluorophenyl)-4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3...
Create Date: 2007-03-07
CID: 15952150

1691. carboline analog, 60; CHEMBL248336; SCHEMBL13248447 ...
MW:     375.463500 g/mol MF: C23H25N3O2
IUPAC name: N-(4-tert-butylphenyl)-4-methyl-1-oxo-2,3,4,9-tetrahydropyri...
Create Date: 2007-03-07
CID: 15952058

1692. carboline analog, 48; CHEMBL246906; SCHEMBL2992307 ...
MW:     333.383760 g/mol MF: C20H19N3O2
IUPAC name: 4-methyl-N-(3-methylphenyl)-1-oxo-2,3,4,9-tetrahydropyrido[3...
Create Date: 2007-03-07
CID: 15952054

1693. carboline analog, 40; CHEMBL392596; SCHEMBL2989265 ...
MW:     321.333300 g/mol MF: C17H15N5O2
IUPAC name: 4-methyl-1-oxo-N-pyrazin-2-yl-2,3,4,9-tetrahydropyrido[3,4-b...
Create Date: 2007-03-07
CID: 15952051

1694. carboline analog, 38; CHEMBL394735; SCHEMBL2999351 ...
MW:     310.307360 g/mol MF: C16H14N4O3
IUPAC name: 4-methyl-N-(1,2-oxazol-3-yl)-1-oxo-2,3,4,9-tetrahydropyrido[...
Create Date: 2007-03-07
CID: 15951958

1695. carboline analog, 63; CHEMBL245474; SCHEMBL13248433 ...
MW:     398.253240 g/mol MF: C19H16BrN3O2
IUPAC name: N-(4-bromophenyl)-4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,...
Create Date: 2007-03-07
CID: 15951956

1696. carboline analog, 61; CHEMBL395593; SCHEMBL13248431 ...
MW:     337.347643 g/mol MF: C19H16FN3O2
IUPAC name: N-(4-fluorophenyl)-4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3...
Create Date: 2007-03-07
CID: 15951865

1697. carboline analog, 53; CHEMBL246699; SCHEMBL13248429 ...
MW:     398.253240 g/mol MF: C19H16BrN3O2
IUPAC name: N-(3-bromophenyl)-4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,...
Create Date: 2007-03-07
CID: 15951863

1698. carboline analog, 46; CHEMBL429474; SCHEMBL13248415 ...
MW:     344.366640 g/mol MF: C20H16N4O2
IUPAC name: N-(2-cyanophenyl)-4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,...
Create Date: 2007-03-07
CID: 15951859

1699. carboline analog, 57; CHEMBL248532; SCHEMBL13248412 ...
MW:     362.381920 g/mol MF: C20H18N4O3
IUPAC name: N-(3-carbamoylphenyl)-4-methyl-1-oxo-2,3,4,9-tetrahydropyrid...
Create Date: 2007-03-07
CID: 15951769

1700. carboline analog, 67; CHEMBL442419; SCHEMBL13248411 ...
MW:     362.381920 g/mol MF: C20H18N4O3
IUPAC name: N-(4-carbamoylphenyl)-4-methyl-1-oxo-2,3,4,9-tetrahydropyrid...
Create Date: 2007-03-07
CID: 15951768

1701. carboline analog, 55; CHEMBL248331; SCHEMBL3004291 ...
MW:     391.419840 g/mol MF: C22H21N3O4
IUPAC name: ethyl 3-[(4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]indo...
Create Date: 2007-03-07
CID: 15951678

1702. carboline analog, 64; CHEMBL245475; SCHEMBL13248407 ...
MW:     344.366640 g/mol MF: C20H16N4O2
IUPAC name: N-(4-cyanophenyl)-4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,...
Create Date: 2007-03-07
CID: 15951677

1703. carboline analog, 37; CHEMBL247510; SCHEMBL3001256 ...
MW:     326.372960 g/mol MF: C16H14N4O2S
IUPAC name: 4-methyl-1-oxo-N-(1,3-thiazol-2-yl)-2,3,4,9-tetrahydropyrido...
Create Date: 2007-03-07
CID: 15951676

1704. carboline analog, 54; CHEMBL246910; SCHEMBL13248403 ...
MW:     344.366640 g/mol MF: C20H16N4O2
IUPAC name: N-(3-cyanophenyl)-4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,...
Create Date: 2007-03-07
CID: 15951675

1705. carboline analog, 52; CHEMBL395592; SCHEMBL13248395 ...
MW:     353.802240 g/mol MF: C19H16ClN3O2
IUPAC name: N-(3-chlorophenyl)-4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3...
Create Date: 2007-03-07
CID: 15951577

1706. carboline analog, 35; CHEMBL437943; SCHEMBL3005586 ...
MW:     320.345240 g/mol MF: C18H16N4O2
IUPAC name: 4-methyl-1-oxo-N-pyridin-3-yl-2,3,4,9-tetrahydropyrido[3,4-b...
Create Date: 2007-03-07
CID: 15951576

1707. carboline analog, 62; CHEMBL245473; SCHEMBL13248391 ...
MW:     353.802240 g/mol MF: C19H16ClN3O2
IUPAC name: N-(4-chlorophenyl)-4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3...
Create Date: 2007-03-07
CID: 15951575

1708. carboline analog, 36; CHEMBL247509; SCHEMBL2996054 ...
MW:     320.345240 g/mol MF: C18H16N4O2
IUPAC name: 4-methyl-1-oxo-N-pyridin-4-yl-2,3,4,9-tetrahydropyrido[3,4-b...
Create Date: 2007-03-07
CID: 15951573

1709. [2'-hydroxy-3'-(1H-pyrrolo[3,2-c]pyridin-2-yl)-biphenyl-3-ylmethyl]-urea; 2flr; 5-azaindole analog 2 ...
MW:     358.393220 g/mol MF: C21H18N4O2
IUPAC name: [3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyridin-2-yl)phenyl]phenyl...
Create Date: 2007-02-23
CID: 15942655

1710. Demeton thiono O-analog; SVTSCYNGUUFBIZ-UHFFFAOYSA-N; OR304707 ...
MW:     228.246242 g/mol MF: C7H17O4PS
IUPAC name: 1-diethoxyphosphorylsulfanyl-2-methoxyethane
Create Date: 2007-02-08
CID: 13978405

1711. CHEMBL251975; N-(2-(furan-2-yl)-6-(1H-pyrazol-1-yl)pyrimidin-4-yl)-2-(4-methylpiperazin-1-yl)acetamide; N-[2-(furan-2-yl)-6-(1H-pyrazol-1-yl)pyrimidin-4-yl]-2-(4-methylpiperazin-1-yl)acetamide ...
MW:     367.405040 g/mol MF: C18H21N7O2
IUPAC name: N-[2-(furan-2-yl)-6-pyrazol-1-ylpyrimidin-4-yl]-2-(4-methylp...
Create Date: 2006-11-29
CID: 11956193

1712. Pyrazinone Analog 31a; CHEMBL130812; BDBM14566 ...
MW:     549.451040 g/mol MF: C28H26Cl2N6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-chloro-2-(2-chlorophe...
Create Date: 2006-10-28
CID: 11827739

1713. Pyrazinone Analog 28l; CHEMBL131250; BDBM14541 ...
MW:     523.069500 g/mol MF: C28H35ClN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-(octan-3-yla...
Create Date: 2006-10-28
CID: 11827475

1714. Pyrazinone Analog 25a; CHEMBL132042; BDBM14509 ...
MW:     486.952820 g/mol MF: C26H23ClN6O2
IUPAC name: 2-(3-anilino-5-chloro-2-oxo-6-phenylpyrazin-1-yl)-N-[(4-carb...
Create Date: 2006-10-28
CID: 11827030

1715. Pyrazinone Analog 29b; CHEMBL133007; BDBM14528 ...
MW:     453.924660 g/mol MF: C22H24ClN7O2
IUPAC name: 2-[2-(3-aminophenyl)-3-chloro-5-(ethylamino)-6-oxopyrazin-1-...
Create Date: 2006-10-28
CID: 11826539

1716. Pyrazinone Analog 26f; CHEMBL424264; BDBM14519 ...
MW:     549.451040 g/mol MF: C28H26Cl2N6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-[2-(4-chloro...
Create Date: 2006-10-27
CID: 11813618

1717. Pyrazinone Analog 31k; CHEMBL337678; BDBM14576 ...
MW:     529.032560 g/mol MF: C29H29ClN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-chloro-2-(3-methylphe...
Create Date: 2006-10-27
CID: 11813421

1718. Pyrazinone Analog 28j; CHEMBL337278; BDBM14539 ...
MW:     509.042920 g/mol MF: C27H33ClN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-(heptan-4-yl...
Create Date: 2006-10-27
CID: 11813203

1719. Pyrazinone Analog 27a; CHEMBL131521; BDBM14521 ...
MW:     464.947300 g/mol MF: C24H25ClN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-(5-chloro-2-oxo-6-phenyl...
Create Date: 2006-10-27
CID: 11812634

1720. Pyrazinone Analog 28b; CHEMBL130603; BDBM14527 ...
MW:     438.910020 g/mol MF: C22H23ClN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-(ethylamino)...
Create Date: 2006-10-27
CID: 11812211

1721. Begacestat analogue, 7; BMCL184232 Compound 8e; CHEMBL452797 ...
MW:     305.820800 g/mol MF: C13H20ClNO3S
IUPAC name: 4-chloro-N-[(2S)-3-ethyl-1-hydroxypentan-2-yl]benzenesulfona...
Create Date: 2006-10-26
CID: 11779875

1722. thiourea analogue, 61; CHEMBL229218; SCHEMBL5947669 ...
MW:     461.640540 g/mol MF: C23H31N3O3S2
IUPAC name: 1-[(4-tert-butylphenyl)methyl]-3-[1-[4-(methanesulfonamido)-...
Create Date: 2006-10-26
CID: 11775574

1723. Pyrazinone Analog 25b; CHEMBL133623; BDBM14510 ...
MW:     500.979400 g/mol MF: C27H25ClN6O2
IUPAC name: 2-[3-(benzylamino)-5-chloro-2-oxo-6-phenylpyrazin-1-yl]-N-[(...
Create Date: 2006-10-26
CID: 11762839

1724. Pyrazinone Analog 24d; CHEMBL131190; BDBM14501 ...
MW:     481.548980 g/mol MF: C27H27N7O2
IUPAC name: N-[(6-carbamimidoylpyridin-3-yl)methyl]-2-[2-oxo-6-phenyl-3-...
Create Date: 2006-10-26
CID: 11762589

1725. thiourea analogue, 32; CHEMBL265865; SCHEMBL5947887 ...
MW:     465.647483 g/mol MF: C23H32FN3O2S2
IUPAC name: 1-[(4-tert-butylphenyl)methyl]-3-[1-[3-fluoro-4-(methanesulf...
Create Date: 2006-10-26
CID: 11751650

1726. 777946-66-4; Thioamide Analogue 28; BDBM12446 ...
MW:     226.381480 g/mol MF: C12H22N2S
IUPAC name: 2-(cyclohexylamino)-1-pyrrolidin-1-ylethanethione
Create Date: 2006-10-26
CID: 11736293

1727. Pyrazinone Analog 26g; BDBM14520; N-[(4-carbamimidoylphenyl)methyl]-2-(5-chloro-3-{[2-(3-chlorophenyl)ethyl]amino}-2-oxo-6-phenyl-1,2-dihydropyrazin-1-yl)acetamide
MW:     549.451040 g/mol MF: C28H26Cl2N6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-[2-(3-chloro...
Create Date: 2006-10-26
CID: 11734310

1728. Pyrazinone Analog 28q; CHEMBL131472; BDBM14547 ...
MW:     545.075020 g/mol MF: C30H33ClN6O2
IUPAC name: 2-[3-(1-adamantylamino)-5-chloro-2-oxo-6-phenylpyrazin-1-yl]...
Create Date: 2006-10-26
CID: 11734268

1729. Pyrazinone Analog 28aa; CHEMBL337214; BDBM14560 ...
MW:     496.004400 g/mol MF: C25H30ClN7O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-[3-(dimethyl...
Create Date: 2006-10-26
CID: 11733750

1730. Pyrazinone Analog 28w; CHEMBL336768; BDBM14555 ...
MW:     453.924660 g/mol MF: C22H24ClN7O2
IUPAC name: 2-[3-(2-aminoethylamino)-5-chloro-2-oxo-6-phenylpyrazin-1-yl...
Create Date: 2006-10-26
CID: 11733131

1731. Pyrazinone Analog 31n; CHEMBL131056; BDBM14579 ...
MW:     545.031960 g/mol MF: C29H29ClN6O3
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-chloro-2-(3-methoxyph...
Create Date: 2006-10-26
CID: 11731292

1732. Pyrazinone Analog 24g; CHEMBL133069; BDBM14504 ...
MW:     480.001700 g/mol MF: C26H30ClN5O2
IUPAC name: 2-[5-chloro-2-oxo-6-phenyl-3-(2-phenylethylamino)pyrazin-1-y...
Create Date: 2006-10-26
CID: 11730512

1733. Pyrazinone Analog 28e; CHEMBL127553; BDBM14531 ...
MW:     448.904840 g/mol MF: C23H21ClN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-2-oxo-6-phenyl...
Create Date: 2006-10-26
CID: 11730048

1734. Pyrazinone Analog 28a; CHEMBL131490; BDBM14525 ...
MW:     424.883440 g/mol MF: C21H21ClN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-(methylamino...
Create Date: 2006-10-26
CID: 11729577

1735. Pyridine Analogue 21e; CHEMBL198682; BDBM10353 ...
MW:     495.522683 g/mol MF: C25H22FN3O5S
IUPAC name: 1-[(4-fluorophenyl)methyl]-5-[(2S)-2-(pyridin-3-yloxymethyl)...
Create Date: 2006-10-26
CID: 11705942

1736. Pyridine Analogue 21d; CHEMBL198755; BDBM10352 ...
MW:     523.623800 g/mol MF: C26H25N3O5S2
IUPAC name: 1-[(4-methylsulfanylphenyl)methyl]-5-[(2S)-2-(pyridin-3-ylox...
Create Date: 2006-10-26
CID: 11670894

1737. Pyridine Analogue 21a; CHEMBL371879; BDBM10349 ...
MW:     401.436260 g/mol MF: C19H19N3O5S
IUPAC name: 1-methyl-5-[(2S)-2-(pyridin-3-yloxymethyl)pyrrolidin-1-yl]su...
Create Date: 2006-10-26
CID: 11647018

1738. NSCI; 1-(4-Methyoxybenzyl)-5-(2-(pyridin-3-yl-oxymethyl)-pyrrolidine-1-sulfonyl)-1H-indole-2,3-dione; 872254-32-5 ...
MW:     507.558200 g/mol MF: C26H25N3O6S
IUPAC name: 1-[(4-methoxyphenyl)methyl]-5-[(2S)-2-(pyridin-3-yloxymethyl...
Create Date: 2006-10-26
CID: 11591540

1739. Pyridine Analogue 21b; CHEMBL197549; BDBM10350 ...
MW:     477.532220 g/mol MF: C25H23N3O5S
IUPAC name: 1-benzyl-5-[(2S)-2-(pyridin-3-yloxymethyl)pyrrolidin-1-yl]su...
Create Date: 2006-10-26
CID: 11576540

1740. thiourea analogue, 34; CHEMBL388282; SCHEMBL5947631 ...
MW:     499.663703 g/mol MF: C26H30FN3O2S2
IUPAC name: 1-[(4-tert-butylphenyl)methyl]-3-[[3-fluoro-4-(methanesulfon...
Create Date: 2006-10-26
CID: 11488914

1741. Saxagliptin Analogue 8b; CHEMBL3350922; BDBM11527 ...
MW:     261.362620 g/mol MF: C15H23N3O
IUPAC name: (1S,3S,5S)-2-[(2S)-2-amino-3,3-diethylpent-4-enoyl]-2-azabic...
Create Date: 2006-10-26
CID: 11474308

1742. thiourea analogue, 59; CHEMBL229214; SCHEMBL5674634 ...
MW:     449.629840 g/mol MF: C22H31N3O3S2
IUPAC name: 1-[(4-tert-butylphenyl)methyl]-3-[1-[4-(methanesulfonamido)-...
Create Date: 2006-10-26
CID: 11453708

1743. thiourea analogue, 33; CHEMBL229162; SCHEMBL5674998 ...
MW:     513.690283 g/mol MF: C27H32FN3O2S2
IUPAC name: 1-[(4-tert-butylphenyl)methyl]-3-[1-[3-fluoro-4-(methanesulf...
Create Date: 2006-10-26
CID: 11443680

1744. thiourea analogue, 11; CHEMBL228728; SCHEMBL5674763 ...
MW:     437.594323 g/mol MF: C21H28FN3O2S2
IUPAC name: 1-[(4-tert-butylphenyl)methyl]-3-[1-[3-fluoro-4-(methanesulf...
Create Date: 2006-10-26
CID: 11430541

1745. Saxagliptin Analogue 8c; CHEMBL3350923; BDBM11528 ...
MW:     245.320160 g/mol MF: C14H19N3O
IUPAC name: (1S,3S,5S)-2-[(2S)-2-amino-2-(1-ethenylcyclobutyl)acetyl]-2-...
Create Date: 2006-10-26
CID: 11428334

1746. Saxagliptin Analogue 8a; CHEMBL3350930; BDBM11525 ...
MW:     233.309460 g/mol MF: C13H19N3O
IUPAC name: (1S,3S,5S)-2-[(2S)-2-amino-3,3-dimethylpent-4-enoyl]-2-azabi...
Create Date: 2006-10-26
CID: 11405274

1747. Saxagliptin Analogue 8g; CHEMBL3350928; BDBM11532 ...
MW:     275.346140 g/mol MF: C15H21N3O2
IUPAC name: (1S,3S,5S)-2-[(2S)-2-amino-2-(4-ethenyloxan-4-yl)acetyl]-2-a...
Create Date: 2006-10-26
CID: 11395141

1748. UNII-51JV4753AD; GSI-136; 443989-01-3 ...
MW:     311.848520 g/mol MF: C11H18ClNO3S2
IUPAC name: 5-chloro-N-[(2S)-3-ethyl-1-hydroxypentan-2-yl]thiophene-2-su...
Create Date: 2006-10-26
CID: 11358855

1749. Saxagliptin Analogue 8f; CHEMBL3350927; BDBM11531 ...
MW:     287.399900 g/mol MF: C17H25N3O
IUPAC name: (1S,3S,5S)-2-[(2S)-2-amino-2-(1-ethenylcycloheptyl)acetyl]-2...
Create Date: 2006-10-26
CID: 11350142

1750. Thioamide Analogue 30; BDBM12448; 16.1c ...
MW:     278.369920 g/mol MF: C14H18N2O2S
IUPAC name: 2-(1,3-benzodioxol-5-ylmethylamino)-1-pyrrolidin-1-ylethanet...
Create Date: 2006-10-26
CID: 11311984

1751. thiourea analogue, 31; CHEMBL228465; SCHEMBL5947823 ...
MW:     451.620903 g/mol MF: C22H30FN3O2S2
IUPAC name: 1-[(4-tert-butylphenyl)methyl]-3-[1-[3-fluoro-4-(methanesulf...
Create Date: 2006-10-26
CID: 11305503

1752. Saxagliptin Analogue 8d; CHEMBL3350932; SCHEMBL14899587 ...
MW:     259.346740 g/mol MF: C15H21N3O
IUPAC name: (1S,3S,5S)-2-[(2S)-2-amino-2-(1-ethenylcyclopentyl)acetyl]-2...
Create Date: 2006-10-26
CID: 11253949

1753. thiourea analogue, 58; CHEMBL229163; SCHEMBL5947774 ...
MW:     451.620903 g/mol MF: C22H30FN3O2S2
IUPAC name: 1-[(4-tert-butylphenyl)methyl]-3-[2-[3-fluoro-4-(methanesulf...
Create Date: 2006-10-26
CID: 11247955

1754. Thioamide Analogue 29; BDBM12447; 16.1b ...
MW:     234.360420 g/mol MF: C13H18N2S
IUPAC name: 2-(benzylamino)-1-pyrrolidin-1-ylethanethione
Create Date: 2006-10-26
CID: 11241805

1755. Saxagliptin Analogue 8e; CHEMBL3350934; BDBM11530 ...
MW:     273.373320 g/mol MF: C16H23N3O
IUPAC name: (1S,3S,5S)-2-[(2S)-2-amino-2-(1-ethenylcyclohexyl)acetyl]-2-...
Create Date: 2006-10-26
CID: 11222935

1756. thiourea analogue, 56; CHEMBL228725; SCHEMBL5947730 ...
MW:     433.630440 g/mol MF: C22H31N3O2S2
IUPAC name: 1-[(4-tert-butylphenyl)methyl]-3-[2-[4-(methanesulfonamido)p...
Create Date: 2006-10-26
CID: 11212675

1757. thiourea analogue, 57; CHEMBL228676; SCHEMBL5947732 ...
MW:     431.614560 g/mol MF: C22H29N3O2S2
IUPAC name: 1-[(4-tert-butylphenyl)methyl]-3-[1-[4-(methanesulfonamido)p...
Create Date: 2006-10-26
CID: 11166340

1758. thiourea analogue, 10; CHEMBL288760; SCHEMBL4622076 ...
MW:     419.603860 g/mol MF: C21H29N3O2S2
IUPAC name: 1-[(4-tert-butylphenyl)methyl]-3-[1-[4-(methanesulfonamido)p...
Create Date: 2006-10-26
CID: 11166045

1759. Sulindac analogue, 18; BDBM84521
MW:     355.225200 g/mol MF: C19H15BrO2
IUPAC name: 2-[(3Z)-3-benzylidene-6-bromo-2-methylinden-1-yl]acetic acid
Create Date: 2006-10-26
CID: 11164100

1760. Pyrazinone Analog 26a; CHEMBL336074; BDBM14513 ...
MW:     568.977370 g/mol MF: C28H24ClF3N6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-2-oxo-6-phenyl...
Create Date: 2006-10-26
CID: 11146191

1761. Pyrazinone Analog 25d; CHEMBL338952; BDBM14512 ...
MW:     543.059140 g/mol MF: C30H31ClN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-2-oxo-6-phenyl...
Create Date: 2006-10-26
CID: 11145990

1762. Pyrazinone Analog 29c; CHEMBL133006; BDBM14533 ...
MW:     481.977820 g/mol MF: C24H28ClN7O2
IUPAC name: 2-[2-(3-aminophenyl)-5-(butylamino)-3-chloro-6-oxopyrazin-1-...
Create Date: 2006-10-26
CID: 11145308

1763. Pyrazinone Analog 31b; CHEMBL335187; BDBM14567 ...
MW:     549.451040 g/mol MF: C28H26Cl2N6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-chloro-2-(3-chlorophe...
Create Date: 2006-10-26
CID: 11135396

1764. Pyrazinone Analog 29h; BDBM14552; 2-[6-(3-aminophenyl)-5-chloro-3-[(3-hydroxypropyl)amino]-2-oxo-1,2-dihydropyrazin-1-yl]-N-[(4-carbamimidoylphenyl)methyl]acetamide
MW:     483.950640 g/mol MF: C23H26ClN7O3
IUPAC name: 2-[2-(3-aminophenyl)-3-chloro-5-(3-hydroxypropylamino)-6-oxo...
Create Date: 2006-10-26
CID: 11134644

1765. Pyrazinone Analog 31d; CHEMBL133404; BDBM14569 ...
MW:     532.996443 g/mol MF: C28H26ClFN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-chloro-2-(2-fluorophe...
Create Date: 2006-10-26
CID: 11124327

1766. Pyrazinone Analog 29g; BDBM14550; 2-[6-(3-aminophenyl)-5-chloro-3-[(2-methoxyethyl)amino]-2-oxo-1,2-dihydropyrazin-1-yl]-N-[(4-carbamimidoylphenyl)methyl]acetamide
MW:     483.950640 g/mol MF: C23H26ClN7O3
IUPAC name: 2-[2-(3-aminophenyl)-3-chloro-5-(2-methoxyethylamino)-6-oxop...
Create Date: 2006-10-26
CID: 11123717

1767. Pyrazinone Analog 28h; CHEMBL335076; BDBM14536 ...
MW:     480.989760 g/mol MF: C25H29ClN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-2-oxo-3-(penta...
Create Date: 2006-10-26
CID: 11123677

1768. Pyrazinone Analog 28g; CHEMBL130178; BDBM14534 ...
MW:     452.936600 g/mol MF: C23H25ClN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-2-oxo-6-phenyl...
Create Date: 2006-10-26
CID: 11123270

1769. Pyrazinone Analog 31h; CHEMBL131947; BDBM14573 ...
MW:     583.003950 g/mol MF: C29H26ClF3N6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-2-oxo-3-(2-phe...
Create Date: 2006-10-26
CID: 11114562

1770. Pyrazinone Analog 31l; CHEMBL130100; BDBM14577 ...
MW:     529.032560 g/mol MF: C29H29ClN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-chloro-2-(4-methylphe...
Create Date: 2006-10-26
CID: 11114139

1771. Pyrazinone Analog 24c; CHEMBL335755; BDBM14500 ...
MW:     481.548980 g/mol MF: C27H27N7O2
IUPAC name: N-[(5-carbamimidoylpyridin-2-yl)methyl]-2-[2-oxo-6-phenyl-3-...
Create Date: 2006-10-26
CID: 11113624

1772. Pyrazinone Analog 31m; CHEMBL422079; BDBM14578 ...
MW:     545.031960 g/mol MF: C29H29ClN6O3
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-chloro-2-(2-methoxyph...
Create Date: 2006-10-26
CID: 11103558

1773. Pyrazinone Analog 29a; CHEMBL129926; BDBM14526 ...
MW:     439.898080 g/mol MF: C21H22ClN7O2
IUPAC name: 2-[2-(3-aminophenyl)-3-chloro-5-(methylamino)-6-oxopyrazin-1...
Create Date: 2006-10-26
CID: 11102236

1774. Pyrazinone Analog 31o; CHEMBL130815; BDBM14580 ...
MW:     545.031960 g/mol MF: C29H29ClN6O3
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-chloro-2-(4-methoxyph...
Create Date: 2006-10-26
CID: 11092809

1775. CHEMBL75084; Pyrazinone Analog 24a; BDBM14498 ...
MW:     515.005980 g/mol MF: C28H27ClN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-2-oxo-6-phenyl...
Create Date: 2006-10-26
CID: 11092493

1776. Pyrazinone Analog 32b; CHEMBL335491; BDBM14582 ...
MW:     560.003540 g/mol MF: C28H26ClN7O4
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-chloro-2-(3-nitrophen...
Create Date: 2006-10-26
CID: 11082267

1777. Pyrazinone Analog 28k; CHEMBL132051; BDBM14540 ...
MW:     495.016340 g/mol MF: C26H31ClN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-(hexan-2-yla...
Create Date: 2006-10-26
CID: 11081543

1778. Pyrazinone Analog 24i; CHEMBL130202; BDBM14506 ...
MW:     490.984580 g/mol MF: C26H27ClN6O2
IUPAC name: 2-[5-chloro-2-oxo-6-phenyl-3-(2-phenylethylamino)pyrazin-1-y...
Create Date: 2006-10-26
CID: 11081488

1779. Pyrazinone Analog 28z; CHEMBL130371; BDBM14559 ...
MW:     467.951240 g/mol MF: C23H26ClN7O2
IUPAC name: 2-[3-(3-aminopropylamino)-5-chloro-2-oxo-6-phenylpyrazin-1-y...
Create Date: 2006-10-26
CID: 11081135

1780. Pyrazinone Analog 27c; CHEMBL130702; BDBM14523 ...
MW:     466.963180 g/mol MF: C24H27ClN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-[methyl(prop...
Create Date: 2006-10-26
CID: 11081121

1781. Pyrazinone Analog 33d; CHEMBL339692; BDBM14591 ...
MW:     626.028690 g/mol MF: C30H27ClF3N7O3
IUPAC name: N-[3-[1-[2-[(4-carbamimidoylphenyl)methylamino]-2-oxoethyl]-...
Create Date: 2006-10-26
CID: 11072236

1782. Pyrazinone Analog 28p; CHEMBL339732; BDBM14546
MW:     549.106780 g/mol MF: C30H37ClN6O2
IUPAC name: 2-[3-[(4-tert-butylcyclohexyl)amino]-5-chloro-2-oxo-6-phenyl...
Create Date: 2006-10-26
CID: 11071685

1783. Pyrazinone Analog 26b; CHEMBL131559; BDBM14515 ...
MW:     535.424460 g/mol MF: C27H24Cl2N6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-[(4-chloroph...
Create Date: 2006-10-26
CID: 11071571

1784. Pyrazinone Analog 27d; CHEMBL130447; BDBM14524 ...
MW:     518.029760 g/mol MF: C27H24ClN5O2S
IUPAC name: 2-(3-benzylsulfanyl-5-chloro-2-oxo-6-phenylpyrazin-1-yl)-N-[...
Create Date: 2006-10-26
CID: 11071363

1785. Pyrazinone Analog 28v; CHEMBL130067; BDBM14554 ...
MW:     511.015740 g/mol MF: C26H31ClN6O3
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-(6-hydroxyhe...
Create Date: 2006-10-26
CID: 11071275

1786. Pyrazinone Analog 28t; CHEMBL423521; BDBM14551 ...
MW:     468.936000 g/mol MF: C23H25ClN6O3
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-(3-hydroxypr...
Create Date: 2006-10-26
CID: 11070689

1787. Pyrazinone Analog 27b; CHEMBL132845; BDBM14522 ...
MW:     450.920720 g/mol MF: C23H23ClN6O2
IUPAC name: 2-[3-(azetidin-1-yl)-5-chloro-2-oxo-6-phenylpyrazin-1-yl]-N-...
Create Date: 2006-10-26
CID: 11070410

1788. Pyrazinone Analog 25c; CHEMBL133683; BDBM14511 ...
MW:     529.032560 g/mol MF: C29H29ClN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-2-oxo-6-phenyl...
Create Date: 2006-10-26
CID: 11060467

1789. Pyrazinone Analog 28f; CHEMBL128685; BDBM14532 ...
MW:     466.963180 g/mol MF: C24H27ClN6O2
IUPAC name: 2-[3-(butylamino)-5-chloro-2-oxo-6-phenylpyrazin-1-yl]-N-[(4...
Create Date: 2006-10-26
CID: 11059701

1790. Pyrazinone Analog 28n; CHEMBL335171; BDBM14544 ...
MW:     529.011100 g/mol MF: C24H25ClN6O4S
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-[(1,1-dioxot...
Create Date: 2006-10-26
CID: 11049707

1791. Pyrazinone Analog 28bb; CHEMBL133383; BDBM14561 ...
MW:     481.977820 g/mol MF: C24H28ClN7O2
IUPAC name: 2-[3-(4-aminobutylamino)-5-chloro-2-oxo-6-phenylpyrazin-1-yl...
Create Date: 2006-10-26
CID: 11049137

1792. Pyrazinone Analog 30d; CHEMBL336704; BDBM14565 ...
MW:     591.101940 g/mol MF: C34H31ClN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-2-oxo-3-(2-phe...
Create Date: 2006-10-26
CID: 11039222

1793. Pyrazinone Analog 28c; CHEMBL131601; BDBM14529 ...
MW:     452.936600 g/mol MF: C23H25ClN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-2-oxo-6-phenyl...
Create Date: 2006-10-26
CID: 11037772

1794. Pyrazinone Analog 28d; CHEMBL436370; BDBM14530 ...
MW:     450.920720 g/mol MF: C23H23ClN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-2-oxo-6-phenyl...
Create Date: 2006-10-26
CID: 11037740

1795. Pyrazinone Analog 28y; CHEMBL338615; BDBM14558 ...
MW:     524.014500 g/mol MF: C26H30ClN7O3
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-(2-morpholin...
Create Date: 2006-10-26
CID: 11016812

1796. Pyrazinone Analog 29d; CHEMBL444600; BDBM14535 ...
MW:     467.951240 g/mol MF: C23H26ClN7O2
IUPAC name: 2-[2-(3-aminophenyl)-3-chloro-6-oxo-5-(propan-2-ylamino)pyra...
Create Date: 2006-10-26
CID: 11016112

1797. Pyrazinone Analog 28m; CHEMBL131878; BDBM14542 ...
MW:     464.947300 g/mol MF: C24H25ClN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-(cyclobutyla...
Create Date: 2006-10-26
CID: 11016071

1798. Pyrazinone Analog 33c; CHEMBL127554; BDBM14590 ...
MW:     572.057300 g/mol MF: C30H30ClN7O3
IUPAC name: 2-[2-(3-acetamidophenyl)-3-chloro-6-oxo-5-(2-phenylethylamin...
Create Date: 2006-10-26
CID: 11006311

1799. Pyrazinone Analog 33b; CHEMBL128284; BDBM14589 ...
MW:     558.073780 g/mol MF: C30H32ClN7O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-chloro-2-[3-(dimethyl...
Create Date: 2006-10-26
CID: 11006214

1800. Pyrazinone Analog 26d; CHEMBL133273; BDBM14517 ...
MW:     536.960326 g/mol MF: C27H23ClF2N6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-[(3,5-difluo...
Create Date: 2006-10-26
CID: 11006026

1801. Pyrazinone Analog 32c; CHEMBL132151; BDBM14583 ...
MW:     530.020620 g/mol MF: C28H28ClN7O2
IUPAC name: 2-[2-(3-aminophenyl)-3-chloro-6-oxo-5-(2-phenylethylamino)py...
Create Date: 2006-10-26
CID: 11005941

1802. Pyrazinone Analog 32f; CHEMBL130897; BDBM14586 ...
MW:     510.972680 g/mol MF: C25H27ClN6O4
IUPAC name: methyl 3-[1-[2-[(4-carbamimidoylphenyl)methylamino]-2-oxoeth...
Create Date: 2006-10-26
CID: 10984047

1803. Pyrazinone Analog 24e; CHEMBL133456; BDBM14502 ...
MW:     494.587500 g/mol MF: C29H30N6O2
IUPAC name: N-[2-(4-carbamimidoylphenyl)ethyl]-2-[2-oxo-6-phenyl-3-(2-ph...
Create Date: 2006-10-26
CID: 10983850

1804. Pyrazinone Analog 28i; CHEMBL130166; BDBM14538 ...
MW:     480.989760 g/mol MF: C25H29ClN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-2-oxo-3-(penta...
Create Date: 2006-10-26
CID: 10983680

1805. Pyrazinone Analog 31i; CHEMBL340945; BDBM14574 ...
MW:     583.003950 g/mol MF: C29H26ClF3N6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-2-oxo-3-(2-phe...
Create Date: 2006-10-26
CID: 10973926

1806. Pyrazinone Analog 31c; CHEMBL335484; BDBM14568 ...
MW:     549.451040 g/mol MF: C28H26Cl2N6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-chloro-2-(4-chlorophe...
Create Date: 2006-10-26
CID: 10973648

1807. Pyrazinone Analog 31f; CHEMBL412136; BDBM14571 ...
MW:     532.996443 g/mol MF: C28H26ClFN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-chloro-2-(4-fluorophe...
Create Date: 2006-10-26
CID: 10973478

1808. Pyrazinone Analog 30b; CHEMBL339164; BDBM14563 ...
MW:     466.963180 g/mol MF: C24H27ClN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-chloro-2-ethyl-6-oxo-...
Create Date: 2006-10-26
CID: 10972679

1809. Pyrazinone Analog 26c; CHEMBL131884; BDBM14516 ...
MW:     536.960326 g/mol MF: C27H23ClF2N6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-[(2,5-difluo...
Create Date: 2006-10-26
CID: 10962541

1810. Pyrazinone Analog 31e; CHEMBL133125; BDBM14570 ...
MW:     532.996443 g/mol MF: C28H26ClFN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-chloro-2-(3-fluorophe...
Create Date: 2006-10-26
CID: 10962508

1811. Pyrazinone Analog 28u; CHEMBL130120; BDBM14553 ...
MW:     482.962580 g/mol MF: C24H27ClN6O3
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-(4-hydroxybu...
Create Date: 2006-10-26
CID: 10961900

1812. Pyrazinone Analog 32a; CHEMBL131554; BDBM14581 ...
MW:     543.843360 g/mol MF: C24H24BrClN6O2
IUPAC name: 2-[2-(3-bromophenyl)-3-chloro-5-(cyclobutylamino)-6-oxopyraz...
Create Date: 2006-10-26
CID: 10951681

1813. Pyrazinone Analog 31j; CHEMBL336144; BDBM14575 ...
MW:     529.032560 g/mol MF: C29H29ClN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-chloro-2-(2-methylphe...
Create Date: 2006-10-26
CID: 10951552

1814. Pyrazinone Analog 30c; CHEMBL130537; BDBM14564 ...
MW:     529.032560 g/mol MF: C29H29ClN6O2
IUPAC name: 2-[2-benzyl-3-chloro-6-oxo-5-(2-phenylethylamino)pyrazin-1-y...
Create Date: 2006-10-26
CID: 10951551

1815. Pyrazinone Analog 24j; CHEMBL129894; BDBM14507 ...
MW:     490.984580 g/mol MF: C26H27ClN6O2
IUPAC name: 2-[5-chloro-2-oxo-6-phenyl-3-(2-phenylethylamino)pyrazin-1-y...
Create Date: 2006-10-26
CID: 10951082

1816. Pyrazinone Analog 32e; CHEMBL127389; BDBM14585 ...
MW:     480.946700 g/mol MF: C24H25ClN6O3
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-chloro-5-(cyclobutyla...
Create Date: 2006-10-26
CID: 10939772

1817. Pyrazinone Analog 32d; CHEMBL133009; BDBM14584 ...
MW:     480.946700 g/mol MF: C24H25ClN6O3
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-chloro-5-(cyclobutyla...
Create Date: 2006-10-26
CID: 10939771

1818. Pyrazinone Analog 24f; CHEMBL130808; BDBM14503 ...
MW:     480.560920 g/mol MF: C28H28N6O2
IUPAC name: N-[(3-carbamimidoylphenyl)methyl]-2-[2-oxo-6-phenyl-3-(2-phe...
Create Date: 2006-10-26
CID: 10939759

1819. Pyrazinone Analog 31g; CHEMBL338322; BDBM14572 ...
MW:     583.003950 g/mol MF: C29H26ClF3N6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-2-oxo-3-(2-phe...
Create Date: 2006-10-26
CID: 10918949

1820. Pyrazinone Analog 30a; CHEMBL132855; BDBM14562 ...
MW:     452.936600 g/mol MF: C23H25ClN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-chloro-2-methyl-6-oxo...
Create Date: 2006-10-26
CID: 10917410

1821. Pyrazinone Analog 29i; BDBM14557; 2-[6-(3-aminophenyl)-5-chloro-3-{[2-(dimethylamino)ethyl]amino}-2-oxo-1,2-dihydropyrazin-1-yl]-N-[(4-carbamimidoylphenyl)methyl]acetamide
MW:     496.992460 g/mol MF: C24H29ClN8O2
IUPAC name: 2-[2-(3-aminophenyl)-3-chloro-5-[2-(dimethylamino)ethylamino...
Create Date: 2006-10-26
CID: 10907190

1822. Pyrazinone Analog 32g; CHEMBL131473; BDBM14587 ...
MW:     496.946100 g/mol MF: C24H25ClN6O4
IUPAC name: 3-[1-[2-[(4-carbamimidoylphenyl)methylamino]-2-oxoethyl]-3-c...
Create Date: 2006-10-26
CID: 10907189

1823. Pyrazinone Analog 33e; CHEMBL130443; BDBM14592 ...
MW:     608.111000 g/mol MF: C29H30ClN7O4S
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-chloro-2-[3-(methanes...
Create Date: 2006-10-26
CID: 10897344

1824. Pyrazinone Analog 24k; CHEMBL133110; BDBM14508 ...
MW:     512.990100 g/mol MF: C28H25ClN6O2
IUPAC name: N-(1H-benzimidazol-2-ylmethyl)-2-[5-chloro-2-oxo-6-phenyl-3-...
Create Date: 2006-10-26
CID: 10896528

1825. Pyrazinone Analog 28o; CHEMBL130287; BDBM14545 ...
MW:     493.000460 g/mol MF: C26H29ClN6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-(cyclohexyla...
Create Date: 2006-10-26
CID: 10896304

1826. Pyrazinone Analog 28r; CHEMBL131400; BDBM14548 ...
MW:     454.909420 g/mol MF: C22H23ClN6O3
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-(2-hydroxyet...
Create Date: 2006-10-26
CID: 10895707

1827. Pyrazinone Analog 29e; BDBM14537; 2-[6-(3-aminophenyl)-5-chloro-2-oxo-3-(pentan-3-ylamino)-1,2-dihydropyrazin-1-yl]-N-[(4-carbamimidoylphenyl)methyl]acetamide
MW:     496.004400 g/mol MF: C25H30ClN7O2
IUPAC name: 2-[2-(3-aminophenyl)-3-chloro-6-oxo-5-(pentan-3-ylamino)pyra...
Create Date: 2006-10-26
CID: 10885544

1828. Pyrazinone Analog 24h; CHEMBL336273; BDBM14505 ...
MW:     487.980640 g/mol MF: C27H26ClN5O2
IUPAC name: 2-[5-chloro-2-oxo-6-phenyl-3-(2-phenylethylamino)pyrazin-1-y...
Create Date: 2006-10-26
CID: 10885426

1829. Pyrazinone Analog 28x; CHEMBL130228; BDBM14556 ...
MW:     481.977820 g/mol MF: C24H28ClN7O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-[2-(dimethyl...
Create Date: 2006-10-26
CID: 10885334

1830. Pyrazinone Analog 26e; CHEMBL338869; BDBM14518 ...
MW:     583.003950 g/mol MF: C29H26ClF3N6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-2-oxo-6-phenyl...
Create Date: 2006-10-26
CID: 10875598

1831. Pyrazinone Analog 33a; CHEMBL335406; BDBM14588 ...
MW:     544.047200 g/mol MF: C29H30ClN7O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-chloro-2-[3-(methylam...
Create Date: 2006-10-26
CID: 10864521

1832. Pyrazinone Analog 28s; CHEMBL131831; BDBM14549 ...
MW:     468.936000 g/mol MF: C23H25ClN6O3
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-chloro-3-(2-methoxyet...
Create Date: 2006-10-26
CID: 10863632

1833. N-(7-phenylheptyl)-1,2,3,4-tetrahydroacridin-9-amine; benzyl-THA analog 2d; SCHEMBL8485047 ...
MW:     372.545680 g/mol MF: C26H32N2
IUPAC name: N-(7-phenylheptyl)-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2006-10-26
CID: 10761844

1834. N-(9-phenylnonyl)-1,2,3,4-tetrahydroacridin-9-amine; benzyl-THA analog 2f; SCHEMBL8484579 ...
MW:     400.598840 g/mol MF: C28H36N2
IUPAC name: N-(9-phenylnonyl)-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2006-10-26
CID: 10739778

1835. Acyclic analogue, 16; BDBM84511
MW:     272.342200 g/mol MF: C16H20N2O2
IUPAC name: (5Z)-5-[(5-hex-5-enyl-1H-pyrrol-2-yl)methylidene]-4-methoxyp...
Create Date: 2006-10-25
CID: 10707348

1836. Acyclic analogue, 10; BDBM84504; 2-(4-Pentenyl)-5-[4-methoxy-5-[[5-(5-hexenyl)-2-pyrrolyl]methylene]-5H-pyrrole-2-yl]-1H-pyrrole
MW:     389.533140 g/mol MF: C25H31N3O
IUPAC name: (2Z)-2-[(5-hex-5-enyl-1H-pyrrol-2-yl)methylidene]-3-methoxy-...
Create Date: 2006-10-25
CID: 10644068

1837. N-(4-phenylbutyl)-1,2,3,4-tetrahydroacridin-9-amine; benzyl-THA analog 2a; SCHEMBL8483729 ...
MW:     330.465940 g/mol MF: C23H26N2
IUPAC name: N-(4-phenylbutyl)-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2006-10-25
CID: 10640195

1838. N-(10-phenyldecyl)-1,2,3,4-tetrahydroacridin-9-amine; benzyl-THA analog 2g; SCHEMBL8488137 ...
MW:     414.625420 g/mol MF: C29H38N2
IUPAC name: N-(10-phenyldecyl)-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2006-10-25
CID: 10573855

1839. N-(5-phenylpentyl)-1,2,3,4-tetrahydroacridin-9-amine; benzyl-THA analog 2b; SCHEMBL8483798 ...
MW:     344.492520 g/mol MF: C24H28N2
IUPAC name: N-(5-phenylpentyl)-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2006-10-25
CID: 10545415

1840. (3R)-4-[(3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-3-methyl-1,4-diazepan-2-one; 1,4-diazepan-2-one 2b; 2iiv ...
MW:     343.344110 g/mol MF: C16H20F3N3O2
IUPAC name: (3R)-4-[(3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-3-me...
Create Date: 2006-10-25
CID: 10450114

1841. Epoxy analogue, I(c); BDBM85449; AKOS006352576 ...
MW:     145.156440 g/mol MF: C6H11NO3
IUPAC name: (2S)-2-amino-3-[(2S,3S)-3-methyloxiran-2-yl]propanoic acid
Create Date: 2006-10-25
CID: 10441814

1842. Sulindac analogue, 19; BDBM84522; 1-[(Z)-(3-Thienyl)methylene]-2-methyl-6-bromo-1H-indene-3-acetic acid
MW:     361.252920 g/mol MF: C17H13BrO2S
IUPAC name: 2-[(3Z)-5-bromo-2-methyl-3-(thiophen-3-ylmethylidene)inden-1...
Create Date: 2006-10-25
CID: 10406261

1843. N-(8-phenyloctyl)-1,2,3,4-tetrahydroacridin-9-amine; benzyl-THA analog 2e; SCHEMBL8479269 ...
MW:     386.572260 g/mol MF: C27H34N2
IUPAC name: N-(8-phenyloctyl)-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2006-10-25
CID: 10385509

1844. N-(6-phenylhexyl)-1,2,3,4-tetrahydroacridin-9-amine; benzyl-THA analog 2c; SCHEMBL8487074 ...
MW:     358.519100 g/mol MF: C25H30N2
IUPAC name: N-(6-phenylhexyl)-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2006-10-25
CID: 10338472

1845. Thioamide Analogue 40; CHEMBL176062; BDBM12458 ...
MW:     292.396500 g/mol MF: C15H20N2O2S
IUPAC name: 2-(1,3-benzodioxol-5-ylmethylamino)-1-piperidin-1-ylethaneth...
Create Date: 2006-10-25
CID: 10334538

1846. Sulindac analogue, 14; CHEMBL353128; BDBM84517 ...
MW:     284.281723 g/mol MF: C17H13FO3
IUPAC name: 2-[(3Z)-6-fluoro-3-(furan-3-ylmethylidene)-2-methylinden-1-y...
Create Date: 2006-10-25
CID: 10334053

1847. Sulindac analogue, 16; BDBM84519
MW:     414.468123 g/mol MF: C27H23FO3
IUPAC name: 2-[(3Z)-2-ethyl-6-fluoro-3-[(4-phenylmethoxyphenyl)methylide...
Create Date: 2006-10-25
CID: 10309917

1848. Sulindac analogue, 15; BDBM84518
MW:     298.308303 g/mol MF: C18H15FO3
IUPAC name: 2-[(3Z)-2-ethyl-6-fluoro-3-(furan-3-ylmethylidene)inden-1-yl...
Create Date: 2006-10-25
CID: 10286274

1849. Epoxy analogue, I(b); BDBM85448; AKOS006352969 ...
MW:     145.156440 g/mol MF: C6H11NO3
IUPAC name: (2S)-2-amino-3-[(2S,3R)-3-methyloxiran-2-yl]propanoic acid
Create Date: 2006-10-25
CID: 10261210

1850. pyridylfuran analog 14; BDBM9096; CHEMBL370736 ...
MW:     796.231050 g/mol MF: C40H41ClF3N5O7
IUPAC name: (2S)-4-[[5-(4-chlorophenyl)furan-2-yl]methyl]-1-[(2S,4S)-4-(...
Create Date: 2006-10-25
CID: 10234378

1851. Sulindac analogue, 10; BDBM84513
MW:     330.300530 g/mol MF: C19H13F3O2
IUPAC name: 2-[(3Z)-3-[(3,4-difluorophenyl)methylidene]-6-fluoro-2-methy...
Create Date: 2006-10-25
CID: 10193394

1852. Sulindac analogue, 17; BDBM84520; 1-[(Z)-(3-Furanyl)methylene]-2-methyl-5-chloro-1H-indene-3-acetic acid
MW:     300.736320 g/mol MF: C17H13ClO3
IUPAC name: 2-[(3Z)-6-chloro-3-(furan-3-ylmethylidene)-2-methylinden-1-y...
Create Date: 2006-10-25
CID: 10171769

1853. Tie-2 Inhibitor 13; Sulindac analogue, 13; BDBM84516 ...
MW:     300.347323 g/mol MF: C17H13FO2S
IUPAC name: 2-[(3Z)-6-fluoro-2-methyl-3-(thiophen-3-ylmethylidene)inden-...
Create Date: 2006-10-25
CID: 10149545

1854. CHEMBL412885; ATC-120; thiourea analogue, 14 ...
MW:     419.603860 g/mol MF: C21H29N3O2S2
IUPAC name: 1-[(4-tert-butylphenyl)methyl]-3-[(1R)-1-[4-(methanesulfonam...
Create Date: 2006-10-25
CID: 10093552

1855. CHEMBL204336; phenylalanine analog 2; sulfamic acid deriv. 2 ...
MW:     373.424620 g/mol MF: C15H23N3O6S
IUPAC name: [4-[(2S)-3-(methylamino)-2-[(2-methylpropan-2-yl)oxycarbonyl...
Create Date: 2006-10-25
CID: 10090732

1856. Thioamide Analogue 39; CHEMBL175629; BDBM12457 ...
MW:     248.387000 g/mol MF: C14H20N2S
IUPAC name: 2-(benzylamino)-1-piperidin-1-ylethanethione
Create Date: 2006-10-25
CID: 10083376

1857. CHEMBL77490; Pyrazinone Analog 29f; BDBM14543 ...
MW:     479.961940 g/mol MF: C24H26ClN7O2
IUPAC name: 2-[2-(3-aminophenyl)-3-chloro-5-(cyclobutylamino)-6-oxopyraz...
Create Date: 2006-10-25
CID: 10073864

1858. thiourea analogue, 60; CHEMBL229217; SCHEMBL5947651 ...
MW:     463.656420 g/mol MF: C23H33N3O3S2
IUPAC name: 1-[(4-tert-butylphenyl)methyl]-3-[2-[4-(methanesulfonamido)-...
Create Date: 2006-10-25
CID: 10050065

1859. Begacestat analogue, 1; BMCL184232 Compound 2a; CHEMBL488228 ...
MW:     291.794220 g/mol MF: C12H18ClNO3S
IUPAC name: 4-chloro-N-[(2S,3S)-1-hydroxy-3-methylpentan-2-yl]benzenesul...
Create Date: 2006-10-25
CID: 10039936

1860. Acyclic analogue, 15; BDBM84509; 2-[5-(5-Hexenyl)-1H-pyrrole-2-ylmethylene]-3-methoxy-5-[5-(4-pentenyl)-2-thienyl]-2H-pyrrole
MW:     406.583500 g/mol MF: C25H30N2OS
IUPAC name: (2Z)-2-[(5-hex-5-enyl-1H-pyrrol-2-yl)methylidene]-3-methoxy-...
Create Date: 2006-10-25
CID: 10024329

1861. Begacestat analogue, 2; BMCL184232 Compound 2e; CHEMBL499573 ...
MW:     336.245220 g/mol MF: C12H18BrNO3S
IUPAC name: 4-bromo-N-[(2S,3S)-1-hydroxy-3-methylpentan-2-yl]benzenesulf...
Create Date: 2006-10-25
CID: 10019882

1862. Thioamide Analogue 38; CHEMBL175977; BDBM12456 ...
MW:     240.408060 g/mol MF: C13H24N2S
IUPAC name: 2-(cyclohexylamino)-1-piperidin-1-ylethanethione
Create Date: 2006-10-25
CID: 10014539

1863. Sulindac analogue, 12; CHEMBL163514; SCHEMBL17831413 ...
MW:     300.347323 g/mol MF: C17H13FO2S
IUPAC name: 2-[(3Z)-6-fluoro-2-methyl-3-(thiophen-2-ylmethylidene)inden-...
Create Date: 2006-10-25
CID: 9944155

1864. Pyrazinone Analog 24b; CHEMBL131326; BDBM14499 ...
MW:     480.560920 g/mol MF: C28H28N6O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[2-oxo-6-phenyl-3-(2-phe...
Create Date: 2006-10-25
CID: 9934869

1865. Begacestat analogue, 8; CHEMBL472151; SCHEMBL1169173 ...
MW:     297.821940 g/mol MF: C10H16ClNO3S2
IUPAC name: 5-chloro-N-[(2S,3S)-1-hydroxy-3-methylpentan-2-yl]thiophene-...
Create Date: 2006-10-25
CID: 9879302

1866. 2-quinolone analog 2a; CHEMBL371818; SCHEMBL1758280 ...
MW:     480.944940 g/mol MF: C28H21ClN4O2
IUPAC name: 4-[[5-[[4-(3-chlorophenyl)-1-methyl-2-oxoquinolin-6-yl]-hydr...
Create Date: 2006-10-25
CID: 9826475

1867. ZINC07688373; Analogue of 1a, 8f; AC1PDJA9 ...
MW:     350.371220 g/mol MF: C19H18N4O3
IUPAC name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-N-methylbenzami...
Create Date: 2006-07-30
CID: 8801003

1868. ANDROSTENEDONE; (10R,13S)-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-dione; 897-06-3 ...
MW:     284.392660 g/mol MF: C19H24O2
IUPAC name: (10R,13S)-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-c...
Create Date: 2006-06-05
CID: 6710699

1869. T5740012; 5-[(5-phenylthiophen-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione; Thiobarbituric acid-thiophene analogue 23 ...
MW:     314.382100 g/mol MF: C15H10N2O2S2
IUPAC name: 5-[(5-phenylthiophen-2-yl)methylidene]-2-sulfanylidene-1,3-d...
Create Date: 2006-05-10
CID: 6539647

1870. Piritrexim analogue,38; AC1O5AQL; CHEMBL190340 ...
MW:     401.461020 g/mol MF: C23H23N5O2
IUPAC name: 6-[(5-methoxy-2-phenylmethoxyphenyl)methyl]-5-methylpyrido[2...
Create Date: 2006-04-29
CID: 6481089

1871. D2N; ethyl 6-[3-({2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl}methyl)-4-methoxyphenoxy]hexanoate; ethyl 6-[3-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methyl]-4-methoxyphenoxy]hexanoate ...
MW:     453.534040 g/mol MF: C24H31N5O4
IUPAC name: ethyl 6-[3-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl...
Create Date: 2006-04-29
CID: 6481088

1872. ethyl 5-[3-({2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl}methyl)-4-methoxyphenoxy]pentanoate; ethyl 5-[3-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methyl]-4-methoxyphenoxy]pentanoate; Piritrexim analogue,31 ...
MW:     439.507460 g/mol MF: C23H29N5O4
IUPAC name: ethyl 5-[3-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl...
Create Date: 2006-04-29
CID: 6481087

1873. D2K; ethyl 4-[3-({2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl}methyl)-4-methoxyphenoxy]butanoate; ethyl 4-[3-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methyl]-4-methoxyphenoxy]butanoate ...
MW:     425.480880 g/mol MF: C22H27N5O4
IUPAC name: ethyl 4-[3-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl...
Create Date: 2006-04-29
CID: 6481086

1874. 4-[2-({2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl}methyl)-4-methoxyphenoxy]butanoic acid; 4-[2-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methyl]-4-methoxyphenoxy]butanoic acid; Piritrexim analogue, 9 ...
MW:     397.427720 g/mol MF: C20H23N5O4
IUPAC name: 4-[2-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methy...
Create Date: 2006-04-29
CID: 6481076

1875. 6-[3-({2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl}methyl)-4-methoxyphenoxy]hexanoic acid; 6-[3-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methyl]-4-methoxyphenoxy]hexanoic acid; 6-{3-[(2,4-Diamino-5-Methylpyrido[2,3-D]pyrimidin-6-Yl)methyl]-4-Methoxyphenoxy}hexanoic Acid ...
MW:     425.480880 g/mol MF: C22H27N5O4
IUPAC name: 6-[3-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methy...
Create Date: 2006-04-29
CID: 6481075

1876. 5-[3-({2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl}methyl)-4-methoxyphenoxy]pentanoic acid; 5-[3-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methyl]-4-methoxyphenoxy]pentanoic acid; Piritrexim analogue, 7 ...
MW:     411.454300 g/mol MF: C21H25N5O4
IUPAC name: 5-[3-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methy...
Create Date: 2006-04-29
CID: 6481074

1877. 4-[3-({2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl}methyl)-4-methoxyphenoxy]butanoic acid; 4-[3-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methyl]-4-methoxyphenoxy]butanoic acid; Piritrexim analogue, 6 ...
MW:     397.427720 g/mol MF: C20H23N5O4
IUPAC name: 4-[3-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methy...
Create Date: 2006-04-29
CID: 6481073

1878. Nucleoside analogue, 3; AC1O41NS; CHEMBL401257 ...
MW:     283.240720 g/mol MF: C10H13N5O5
IUPAC name: 4-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxol...
Create Date: 2005-10-07
CID: 6320414

1879. NSC614810; Thiosemicarbazone analog; AC1NTQU3 ...
MW:     211.240960 g/mol MF: C8H9N3O2S
IUPAC name: [[(Z)-(5-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]am...
Create Date: 2005-03-26
CID: 5386595

1880. Balanol Benzophenone Ester Analog (+)8; AC1NS3KE; BDBM3251 ...
MW:     523.488100 g/mol MF: C27H25NO10
IUPAC name: [(1S,2S)-2-[(4-hydroxybenzoyl)amino]cyclopentyl] 3,5-dihydro...
Create Date: 2006-01-30
CID: 5328010

1881. 3-Aminopyridin-2(1H)-one analogue 20; AC1NS2OF; BDBM1300 ...
MW:     296.406660 g/mol MF: C19H24N2O
IUPAC name: 5-ethyl-6-methyl-3-(1,2,3,4-tetrahydronaphthalen-1-ylmethyla...
Create Date: 2006-01-30
CID: 5327600

1882. glutamate; hydrogen glutamate; glutamate(1-) ...
MW:     146.121320 g/mol MF: C5H8NO4-
IUPAC name: 2-azaniumylpentanedioate
Create Date: 2004-09-16
CID: 4525487

1883. Compound 2 analog 20; AC1NA9P1; CHEMBL212399 ...
MW:     360.414080 g/mol MF: C14H12N6O2S2
IUPAC name: 1-(2,5-dimethyl-4-nitropyrazol-3-yl)-3-methylsulfanyl-5-thio...
Create Date: 2005-09-14
CID: 4398304

1884. Compound 2 analog 22; AC1N7OFE; Oprea1_759698 ...
MW:     334.416560 g/mol MF: C14H14N4O2S2
IUPAC name: 2,5-dimethyl-4-nitro-N-[(5-thiophen-2-ylthiophen-2-yl)methyl...
Create Date: 2005-09-14
CID: 4305683

1885. 2-[(2-acetylbenzene)sulfonyl]benzoic acid; 2-(2-acetylphenyl)sulfonylbenzoic Acid; Compound 1 analog 12 ...
MW:     304.317780 g/mol MF: C15H12O5S
IUPAC name: 2-(2-acetylphenyl)sulfonylbenzoic acid
Create Date: 2005-09-13
CID: 4270495

1886. ST079277; suramin Na; 2nyr ...
MW:    1291.232060 g/mol MF: C51H34N6O23S6-6
IUPAC name: 8-[[4-methyl-3-[[3-[[3-[[2-methyl-5-[(4,6,8-trisulfonatonaph...
Create Date: 2005-09-12
CID: 3943541

1887. Compound 2 analog 16; AC1MWMQ2; CHEMBL427404 ...
MW:     401.320510 g/mol MF: C14H10F3N5O4S
IUPAC name: N-(3-methyl-4-nitro-1,2-oxazol-5-yl)-5-[2-methyl-5-(trifluor...
Create Date: 2005-09-11
CID: 3776668

1888. Glucosamine analog, 2; AC1MLZH7; BDBM85421 ...
MW:     297.303760 g/mol MF: C14H19NO6
IUPAC name: 2-methyl-N-[2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]benz...
Create Date: 2005-09-06
CID: 3277970

1889. AC1MHDFB; Isoquinoline furanyl urethane analog. 14; CHEMBL432066
MW:     571.747960 g/mol MF: C32H49N3O6
IUPAC name: [(3R,3aS,5S,6aS)-5-methyl-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]...
Create Date: 2005-08-01
CID: 3000859

1890. S-[5-(TRIFLUOROMETHYL)-4H-1,2,4-TRIAZOL-3-YL] 5-(PHENYLETHYNYL)FURAN-2-CARBOTHIOATE; CHEBI:42403; F3F ...
MW:     363.313830 g/mol MF: C16H8F3N3O2S
IUPAC name: S-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl] 5-(2-phenyleth...
Create Date: 2005-07-19
CID: 2822496

1891. ZINC00148901; Compound 2 analog 19; Maybridge3_003775 ...
MW:     300.375440 g/mol MF: C16H16N2O2S
IUPAC name: 3-(furan-2-ylmethylamino)-6,6-dimethyl-4-oxo-5,7-dihydro-2-b...
Create Date: 2005-07-19
CID: 2820775

1892. Maybridge3_003414; Compound 2 analog 18; AC1MDZJ4 ...
MW:     413.922080 g/mol MF: C15H12ClN3O3S3
IUPAC name: N-[4-(4-chlorophenyl)sulfonyl-3-methylsulfanyl-1H-pyrazol-5-...
Create Date: 2005-07-19
CID: 2819269

1893. ZINC01028333; 4-(5-chlorothiophen-2-yl)-2-[(thiophene-2-sulfonyl)methyl]-1,3-thiazole hydrobromide; Compound 2 analog 21 ...
MW:     361.910420 g/mol MF: C12H8ClNO2S4
IUPAC name: 4-(5-chlorothiophen-2-yl)-2-(thiophen-2-ylsulfonylmethyl)-1,...
Create Date: 2005-07-19
CID: 2809433

1894. 4-[(3,5-dibromo-4-hydroxyphenyl)sulphonyl]benzoic acid; CBDivE_003589; AC1MCQIU ...
MW:     436.072620 g/mol MF: C13H8Br2O5S
IUPAC name: 4-(3,5-dibromo-4-hydroxyphenyl)sulfonylbenzoic acid
Create Date: 2005-07-19
CID: 2775844

1895. AC1MCEUI; Compound 2 analog 17; Oprea1_304349 ...
MW:     365.470360 g/mol MF: C16H19N3O3S2
IUPAC name: N-[5-(5-tert-butyl-2-methylfuran-3-yl)-1H-pyrazol-3-yl]thiop...
Create Date: 2005-07-19
CID: 2742278

1896. 2275-06-1; Phosoxalone; Phosalone oxon ...
MW:     351.742962 g/mol MF: C12H15ClNO5PS
IUPAC name: 6-chloro-3-(diethoxyphosphorylsulfanylmethyl)-1,3-benzoxazol...
Create Date: 2005-03-27
CID: 586683

1897. Glutamine, n-hydroxy-; AC1LAOQQ; Glutamine Analogue, 2 ...
MW:     162.143900 g/mol MF: C5H10N2O4
IUPAC name: 2-azaniumyl-5-(hydroxyamino)-5-oxopentanoate
Create Date: 2005-03-27
CID: 517482

1898. CHEMBL56314; Benzoic Acid deriv. 6b; Benzoic Acid Analog 6 ...
MW:     293.281900 g/mol MF: C11H15N7O3
IUPAC name: 4-acetamido-3,5-bis(diaminomethylideneamino)benzoic acid
Create Date: 2005-08-01
CID: 506044

1899. carbocyclic analogue 7; AC1LA28F; CHEMBL54479 ...
MW:     282.335480 g/mol MF: C14H22N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-cyclopentyloxycyclohexene-1...
Create Date: 2005-08-01
CID: 505921

1900. carbocyclic analogue 6; AC1LA28C; CHEMBL53050 ...
MW:     254.282320 g/mol MF: C12H18N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-prop-2-enoxycyclohexene-1-c...
Create Date: 2005-08-01
CID: 505920

1901. (3R,4R,5S)-4-acetamido-5-amino-3-(methoxymethoxy)cyclohexene-1-carboxylic acid; carbocyclic analogue 4; CHEMBL54806 ...
MW:     258.271020 g/mol MF: C11H18N2O5
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-(methoxymethoxy)cyclohexene...
Create Date: 2005-08-01
CID: 505918

1902. AC1LACEE; SATE AZT ANALOG; 2-Hydroxy-2-methyl-thiopropionic acid -(2-{[3-azido-5-(5-methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-tetrahydro-furan-2-ylmethoxy]-[2-(2-hydroxy-2-methyl-propanoylsulfanyl)-ethoxy]-phosphoryloxy}-ethyl) ester ...
MW:     639.636022 g/mol MF: C22H34N5O11PS2
IUPAC name: S-[2-[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-y...
Create Date: 2005-08-01
CID: 485459

1903. AC1LATPX; A74704 analog; (2S)-1-((1S)-1-{3-Methyl-2-[(phenylmethoxy)carbonylamino]butanoylamino}-2-phenylethyl)-2-{3-methyl-2-[(phenylmethoxy)carbonylamino]butanoylamino}-3-phenylpropyl [5-(5-methyl-2,4-dioxo(1,3-dihydropyrimidinyl))(2-2,5-dihydrofuryl)]methyl butane-1,4-dioate ...
MW:    1043.166340 g/mol MF: C57H66N6O13
IUPAC name: 4-O-[(2S,4S)-2,4-bis[[3-methyl-2-(phenylmethoxycarbonylamino...
Create Date: 2005-08-01
CID: 474840

1904. Isoquinoline furanyl urethane analog. 12; AC1LA3GC; CHEMBL323950
MW:     571.747960 g/mol MF: C32H49N3O6
IUPAC name: [(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]fu...
Create Date: 2005-08-01
CID: 461027

1905. Isoquinoline furanyl urethane analog. 11; AC1LA3G9; CHEMBL105753
MW:     557.721380 g/mol MF: C31H47N3O6
IUPAC name: [(3aR,6R,6aS)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] ...
Create Date: 2005-08-01
CID: 461026

1906. Isoquinoline furanyl urethane analog. 8; AC1LA3G0; CHEMBL113090
MW:     555.748560 g/mol MF: C32H49N3O5
IUPAC name: [(3aR,4S,6aR)-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-...
Create Date: 2005-08-01
CID: 461023

1907. Isoquinoline furanyl urethane analog. 2; AC1LA3FO; CHEMBL323752 ...
MW:     607.801660 g/mol MF: C31H49N3O7S
IUPAC name: [(2S,3S)-2-(methoxymethyl)-1,1-dioxothiolan-3-yl] N-[(2S,3R)...
Create Date: 2005-08-01
CID: 461019

1908. Isoquinoline furanyl urethane analog. 1; AC1LA3FL; CHEMBL324223 ...
MW:     575.802860 g/mol MF: C31H49N3O5S
IUPAC name: [(2S,3S)-2-(methoxymethyl)thiolan-3-yl] N-[(2S,3R)-4-[(3S,4a...
Create Date: 2005-08-01
CID: 461018

1909. 93806-84-9; Aminoalkyl UPOC analog; AC1L9V32 ...
MW:     404.372460 g/mol MF: C15H24N4O9
IUPAC name: 2-aminopropyl-[carboxy-[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-...
Create Date: 2005-08-01
CID: 456528

1910. Haloperidol BuNH analog; AC1L9TVE; 4-[4-[3-(Butylamino)phenyl]-4-hydroxypiperidinol]-4'-fluorobutyrophenone ...
MW:     412.540123 g/mol MF: C25H33FN2O2
IUPAC name: 4-[4-[3-(butylamino)phenyl]-4-hydroxypiperidin-1-yl]-1-(4-fl...
Create Date: 2005-08-01
CID: 455916

1911. 5-Br-HEIU; 121749-87-9; 5-Bromo-1-((2-hydroxyethoxy)methyl)-6-iodo-uracil ...
MW:     390.957890 g/mol MF: C7H8BrIN2O4
IUPAC name: 5-bromo-1-(2-hydroxyethoxymethyl)-6-iodopyrimidine-2,4-dione
Create Date: 2005-08-01
CID: 452077

1912. 5-Cl-HEIU; 121749-86-8; 5-Chloro-1-[(2-hydroxyethoxy)methyl]-6-iodo-2,4(1H,3H)-pyrimidinedione ...
MW:     346.506890 g/mol MF: C7H8ClIN2O4
IUPAC name: 5-chloro-1-(2-hydroxyethoxymethyl)-6-iodopyrimidine-2,4-dion...
Create Date: 2005-08-01
CID: 452076

1913. 5-FL-HEIU; 121749-85-7; 5-Fluoro-1-((2-hydroxyethoxy)methyl)-6-iodo-uracil ...
MW:     330.052293 g/mol MF: C7H8FIN2O4
IUPAC name: 5-fluoro-1-(2-hydroxyethoxymethyl)-6-iodopyrimidine-2,4-dion...
Create Date: 2005-08-01
CID: 452075

1914. (2S,4S)-2-AMINO-4,5-EPOXIPENTANOIC ACID; 3-OXIRAN-2YLALANINE; Epoxy analogue, I(a) ...
MW:     131.129860 g/mol MF: C5H9NO3
IUPAC name: (2S)-2-amino-3-[(2S)-oxiran-2-yl]propanoic acid
Create Date: 2005-06-24
CID: 447569

1915. CGS-27023A; CGS 27023A; MMI270 ...
MW:     393.457320 g/mol MF: C18H23N3O5S
IUPAC name: (2R)-N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(pyridin-3-ylmet...
Create Date: 2005-06-24
CID: 446504

1916. [(3,7,11-trimethyl-dodeca-2,6,10-trienyloxycarbamoyl)-methyl]-phosphonic acid; FII; FPP ANALOG ...
MW:     359.397562 g/mol MF: C17H30NO5P
IUPAC name: [2-oxo-2-[[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]am...
Create Date: 2005-03-25
CID: 445015

1917. TALLYSOMYCIN; Talisomycin; Tallysomycin A ...
MW:    1731.862200 g/mol MF: C68H110N22O27S2
IUPAC name: [2-[2-[3-[[5-[[1-[[2-[4-[4-[[4-amino-6-[3-(4-aminobutylamino...
Create Date: 2005-03-26
CID: 430602

1918. NSC93057; 2946-03-4; (3-(2,2-Dimethyl(1,3-dioxolan-4-yl))-7,7-dimethyl-4,6,8-trioxabicyclo(3.3.0)oct-2-yloxy)(((3-(2,2-dimethyl(1,3-dioxolan-4-yl))-7,7-dimethyl-4,6,8-trioxabicyclo(3.3.0)oct-2-yloxy)thioxomethyl)disulfanyl)methane-1-thione ...
MW:     670.832720 g/mol MF: C26H38O12S4
IUPAC name: O-[5-(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-3a,5,6,6a...
Create Date: 2005-03-26
CID: 261137

1919. 2-(benzoylamino)-2-deoxyhexopyranose; N-[2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]benzamide; 14086-91-0 ...
MW:     283.277180 g/mol MF: C13H17NO6
IUPAC name: N-[2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]benzamide
Create Date: 2005-03-26
CID: 253013

1920. pyrimidine-4,6-dicarboxylic acid; 16490-02-1; 4,6-Pyrimidinedicarboxylic acid ...
MW:     168.106960 g/mol MF: C6H4N2O4
IUPAC name: pyrimidine-4,6-dicarboxylic acid
Create Date: 2005-03-26
CID: 239360

1921. BRN 0631319; Adenosine-5'-(N-(2-hydroxyethyl))carboxamide; (2s,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxy-n-(2-hydroxyethyl)tetrahydrofuran-2-carboxamide(non-preferred name) ...
MW:     324.292640 g/mol MF: C12H16N6O5
IUPAC name: (2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-N-(2-hydro...
Create Date: 2005-08-09
CID: 215492

1922. Ethylphosphonic acid; 6779-09-5; Phosphonic acid, ethyl- ...
MW:     110.048942 g/mol MF: C2H7O3P
IUPAC name: ethylphosphonic acid
Create Date: 2005-03-27
CID: 204482

1923. Hydroxycyprazine; 39095-16-4; 4-(cyclopropylamino)-6-(isopropylamino)-1,3,5-triazin-2(1h)-on ...
MW:     209.248300 g/mol MF: C9H15N5O
IUPAC name: 2-(cyclopropylamino)-6-(propan-2-ylamino)-1H-1,3,5-triazin-4...
Create Date: 2005-03-27
CID: 190989

1924. deamido-NAD; deamino-nad+; Nicotinic acid adenine dinucleotide ...
MW:     664.409864 g/mol MF: C21H26N6O15P2
IUPAC name: 1-[(2R,3R,4S,5R)-5-[[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3...
Create Date: 2005-06-01
CID: 165490

1925. 3-Aminopropylphosphonic acid; 13138-33-5; (3-aminopropyl)phosphonic acid ...
MW:     139.090162 g/mol MF: C3H10NO3P
IUPAC name: 3-aminopropylphosphonic acid
Create Date: 2005-03-26
CID: 97587

1926. Bis(4-nitrophenyl) sulfone; 1156-50-9; 4-Nitrophenyl sulfone ...
MW:     308.266720 g/mol MF: C12H8N2O6S
IUPAC name: 1-nitro-4-(4-nitrophenyl)sulfonylbenzene
Create Date: 2005-03-26
CID: 70871

1927. Metrifudil; UNII-7K4GKQ4XSE; CHEMBL331382 ...
MW:     371.390440 g/mol MF: C18H21N5O4
IUPAC name: (2R,3S,4R,5R)-2-(hydroxymethyl)-5-[6-[(2-methylphenyl)methyl...
Create Date: 2005-08-08
CID: 65710

1928. suramin; Germanin; Naganol ...
MW:    1297.279700 g/mol MF: C51H40N6O23S6
IUPAC name: 8-[[4-methyl-3-[[3-[[3-[[2-methyl-5-[(4,6,8-trisulfonaphthal...
Create Date: 2005-03-25
CID: 5361

1929. Roseophilin analogue, 3; BDBM84497
MW:     388.545080 g/mol MF: C26H32N2O
Create Date: 2015-10-07
CID: 91898882

1930. 25H-NBOMe imine analog; QPVMUPLRZMIWJW-CPNJWEJPSA-N
MW:     299.364240 g/mol MF: C18H21NO3
IUPAC name: N-[2-(2,5-dimethoxyphenyl)ethyl]-1-(2-methoxyphenyl)methanim...
Create Date: 2015-04-28
CID: 91711131

1931. UNII-032OC1A6YK; 032OC1A6YK; N-Ethyl dimemebfe ...
MW:     219.279580 g/mol MF: C13H17NO2
IUPAC name: N-ethyl-2-(5-methoxy-1-benzofuran-3-yl)ethanamine
Create Date: 2014-10-20
CID: 81047823

1932. Quinuclidine analogue, 5; BDBM92878
MW:     361.436920 g/mol MF: C22H23N3O2
IUPAC name: N-[(3R)-2-(pyridin-3-ylmethyl)-1-azabicyclo[2.2.2]octan-3-yl...
Create Date: 2013-05-31
CID: 71463351

1933. Quinuclidine analogue, 4; BDBM92877
MW:     400.312180 g/mol MF: C20H22BrN3O
IUPAC name: 4-bromo-N-[(3R)-2-(pyridin-3-ylmethyl)-1-azabicyclo[2.2.2]oc...
Create Date: 2013-05-31
CID: 71463350

1934. Quinuclidine analogue, 3; BDBM92876
MW:     321.416120 g/mol MF: C20H23N3O
IUPAC name: N-[(3R)-2-(pyridin-3-ylmethyl)-1-azabicyclo[2.2.2]octan-3-yl...
Create Date: 2013-05-31
CID: 71463349

1935. Quinuclidine analogue, 2; BDBM92875
MW:     217.310060 g/mol MF: C13H19N3
IUPAC name: (3R)-2-(pyridin-3-ylmethyl)-1-azabicyclo[2.2.2]octan-3-amine
Create Date: 2013-05-31
CID: 71463348

1936. Analogue of 1a, 15a; BDBM93085; N-(6-Amino-1-Benzyl-2,4-Dioxo-1,2,3,4-Tetrahydropyrimidin-5-Yl)benzenesulfonamide ...
MW:     372.398340 g/mol MF: C17H16N4O4S
IUPAC name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)benzenesulfonami...
Create Date: 2012-11-02
CID: 66553087

1937. Benzonitrile analogue, 5g; BDBM86787
MW:     302.165880 g/mol MF: C15H12BrNO
IUPAC name: 4-[2-(4-bromophenyl)ethoxy]benzonitrile
Create Date: 2012-07-07
CID: 57340733

1938. Phosphodiester analog, 5; BDBM86344
MW:    1025.088042 g/mol MF: C43H77N8O18P
IUPAC name: [(2R,3S)-4-amino-3-[[(2S)-3-hydroxy-2-[[(2S)-3-(1H-imidazol-...
Create Date: 2012-07-07
CID: 57340568

1939. Phosphodiester analog, 4l; BDBM86343
MW:     891.002142 g/mol MF: C42H67N8O11P
IUPAC name: [(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-...
Create Date: 2012-07-07
CID: 57340567

1940. Phosphodiester analog, 4k; BDBM86342
MW:     876.975562 g/mol MF: C41H65N8O11P
IUPAC name: [(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-...
Create Date: 2012-07-07
CID: 57340566

1941. Phosphodiester analog, 4i; BDBM86340
MW:     848.922402 g/mol MF: C39H61N8O11P
IUPAC name: [(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-...
Create Date: 2012-07-07
CID: 57340564

1942. Phosphodiester analog, 4h; BDBM86339
MW:     834.895822 g/mol MF: C38H59N8O11P
IUPAC name: [(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-...
Create Date: 2012-07-07
CID: 57340563

1943. Phosphodiester analog, 4g; BDBM86338
MW:     820.869242 g/mol MF: C37H57N8O11P
IUPAC name: [(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-...
Create Date: 2012-07-07
CID: 57340562

1944. Phosphodiester analog, 4f; BDBM86337
MW:     806.842662 g/mol MF: C36H55N8O11P
IUPAC name: [(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-...
Create Date: 2012-07-07
CID: 57340561

1945. Phosphodiester analog, 4e; BDBM86336
MW:     784.817222 g/mol MF: C32H49N8O11PS
IUPAC name: [(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-...
Create Date: 2012-07-07
CID: 57340560

1946. Phosphodiester analog, 4d; BDBM86335
MW:     756.783982 g/mol MF: C32H53N8O11P
IUPAC name: [(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-...
Create Date: 2012-07-07
CID: 57340559

1947. Phosphodiester analog, 4c; BDBM86334
MW:     746.703042 g/mol MF: C29H47N8O13P
IUPAC name: 3-[5-[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-2-carbonyl)amino...
Create Date: 2012-07-07
CID: 57340558

1948. Phosphodiester analog, 4b; BDBM86333
MW:     762.745502 g/mol MF: C30H51N8O13P
IUPAC name: [(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-...
Create Date: 2012-07-07
CID: 57340557

1949. Phosphodiester analog, 4a; BDBM86332
MW:     688.666962 g/mol MF: C27H45N8O11P
IUPAC name: [(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-...
Create Date: 2012-07-07
CID: 57340556

1950. Phosphodiester analog, 3l; BDBM86331
MW:     891.002142 g/mol MF: C42H67N8O11P
IUPAC name: [(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-...
Create Date: 2012-07-07
CID: 57340555

1951. Phosphodiester analog, 3k; BDBM86330
MW:     876.975562 g/mol MF: C41H65N8O11P
IUPAC name: [(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-...
Create Date: 2012-07-07
CID: 57340554

1952. Phosphodiester analog, 3j; BDBM86329
MW:     862.948982 g/mol MF: C40H63N8O11P
IUPAC name: [(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-...
Create Date: 2012-07-07
CID: 57340553

1953. Phosphodiester analog, 3i; BDBM86328
MW:     848.922402 g/mol MF: C39H61N8O11P
IUPAC name: [(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-...
Create Date: 2012-07-07
CID: 57340552

1954. Phosphodiester analog, 3h; BDBM86327
MW:     834.895822 g/mol MF: C38H59N8O11P
IUPAC name: [(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-...
Create Date: 2012-07-07
CID: 57340551

1955. Phosphodiester analog, 3g; BDBM86326
MW:     820.869242 g/mol MF: C37H57N8O11P
IUPAC name: [(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-...
Create Date: 2012-07-07
CID: 57340550

1956. Phosphodiester analog, 3f; BDBM86325
MW:     806.842662 g/mol MF: C36H55N8O11P
IUPAC name: [(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-...
Create Date: 2012-07-07
CID: 57340549

1957. Phosphodiester analog, 3e; BDBM86324
MW:     784.817222 g/mol MF: C32H49N8O11PS
IUPAC name: [(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-...
Create Date: 2012-07-07
CID: 57340548

1958. Phosphodiester analog, 3d; BDBM86323
MW:     756.783982 g/mol MF: C32H53N8O11P
IUPAC name: [(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-...
Create Date: 2012-07-07
CID: 57340547

1959. Phosphodiester analog, 3c; BDBM86322
MW:     746.703042 g/mol MF: C29H47N8O13P
IUPAC name: 3-[[(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidi...
Create Date: 2012-07-07
CID: 57340546

1960. Phosphodiester analog, 3b; BDBM86321
MW:     762.745502 g/mol MF: C30H51N8O13P
IUPAC name: [(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-...
Create Date: 2012-07-07
CID: 57340545

1961. Phosphodiester analog, 3a; BDBM86320
MW:     688.666962 g/mol MF: C27H45N8O11P
IUPAC name: [(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-...
Create Date: 2012-07-07
CID: 57340544

1962. Phosphodiester analog, 2; BDBM86319
MW:     672.667562 g/mol MF: C27H45N8O10P
IUPAC name: [(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-...
Create Date: 2012-07-07
CID: 57340543

1963. Phosphodiester analog, 1; BDBM86318
MW:     674.640382 g/mol MF: C26H43N8O11P
IUPAC name: [(2R,3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(1-acetylpyrrolidine-...
Create Date: 2012-07-07
CID: 57340542

1964. Substrate analogue, 33; BDBM82208; 5-[(3-Nitropropionyl)amino]pentanoic acid
MW:     218.207160 g/mol MF: C8H14N2O5
IUPAC name: 5-(3-nitropropanoylamino)pentanoic acid
Create Date: 2012-07-07
CID: 57339533

1965. Substrate analogue, 32; BDBM82207; 5-[(3-Carboxypropionyl)amino]pentanoic acid
MW:     217.219100 g/mol MF: C9H15NO5
IUPAC name: 5-(3-carboxypropanoylamino)pentanoic acid
Create Date: 2012-07-07
CID: 57339532

1966. Substrate analogue, 31; 9-nitro-4-oxononanoic acid; BDBM82206
MW:     217.219100 g/mol MF: C9H15NO5
IUPAC name: 9-nitro-4-oxononanoic acid
Create Date: 2012-07-07
CID: 57339531

1967. Substrate analogue, 29; BDBM82205; 3-Nitro-N-(4-nitro-2-oxobutyl)propionamide
MW:     233.178740 g/mol MF: C7H11N3O6
IUPAC name: 3-nitro-N-(4-nitro-2-oxobutyl)propanamide
Create Date: 2012-07-07
CID: 57339530

1968. Substrate analogue, 28; BDBM82204; Methyl [(4-nitro-2-oxobutyl)carbamoyl]propionate
MW:     246.217260 g/mol MF: C9H14N2O6
IUPAC name: methyl 4-[(4-nitro-2-oxobutyl)amino]-4-oxobutanoate
Create Date: 2012-07-07
CID: 57339529

1969. Substrate analogue, 24; BDBM82203; 4-Oxo-5-(4-methoxy-4-oxobutyrylamino)pentanoic acid
MW:     245.229200 g/mol MF: C10H15NO6
IUPAC name: 5-[(4-methoxy-4-oxobutanoyl)amino]-4-oxopentanoic acid
Create Date: 2012-07-07
CID: 57339528

1970. Substrate analogue, 18; 1-Fluoro-4-nitrobutane-2-one; BDBM82199
MW:     135.093743 g/mol MF: C4H6FNO3
IUPAC name: 1-fluoro-4-nitrobutan-2-one
Create Date: 2012-07-07
CID: 57339527

1971. Omethoate-d3; 1189510-77-7; Folimat-d3 ...
MW:     216.210327 g/mol MF: C5H12NO4PS
IUPAC name: 2-dimethoxyphosphorylsulfanyl-N-(trideuteriomethyl)acetamide
Create Date: 2010-07-26
CID: 46782632

1972. Fumarranol Analog, 10; CHEMBL216033; BDBM81355
MW:     282.375240 g/mol MF: C16H26O4
IUPAC name: (1S,2R,5S)-5-(hydroxymethyl)-1-methoxy-6-[(2R,3R)-2-methyl-3...
Create Date: 2009-11-19
CID: 44416056

1973. CHEMBL298247; spiro[(2-hydroxy)indane-1,40-piperidine] analogue; BDBM50090487 ...
MW:     655.607900 g/mol MF: C35H40Cl2N2O6
IUPAC name: [(2R)-2-(3,4-dichlorophenyl)-2-[2-[(2R)-2-hydroxyspiro[1,2-d...
Create Date: 2009-11-19
CID: 44290659

1974. CHEMBL46795; spiro[(2-hydroxy)indane-1,40-piperidine] analogue; BDBM50090484 ...
MW:     655.607900 g/mol MF: C35H40Cl2N2O6
IUPAC name: [(2S)-2-(3,4-dichlorophenyl)-2-[2-[(2R)-2-hydroxyspiro[1,2-d...
Create Date: 2009-11-19
CID: 44290490

1975. CHEMBL295785; spiro[(2-hydroxy)indane-1,40-piperidine] analogue; BDBM50090482 ...
MW:     655.607900 g/mol MF: C35H40Cl2N2O6
IUPAC name: [(2S)-2-(3,4-dichlorophenyl)-2-[2-[(2S)-2-hydroxyspiro[1,2-d...
Create Date: 2009-11-19
CID: 44290425

1976. Mannostatin analogue, 4a; BDBM84615; AKOS006348202 ...
MW:     149.145140 g/mol MF: C5H11NO4
IUPAC name: (1R,2R,3S,4R)-5-aminocyclopentane-1,2,3,4-tetrol
Create Date: 2009-07-09
CID: 42628065

1977. casimiroin analogue, 1r; CHEMBL455593; BDBM29229
MW:     293.315060 g/mol MF: C15H19NO5
IUPAC name: 5,6,7,8-tetramethoxy-1,4-dimethylquinolin-2-one
Create Date: 2009-06-25
CID: 42618035

1978. casimiroin analogue, 1q; CHEMBL493182; BDBM29228
MW:     279.288480 g/mol MF: C14H17NO5
IUPAC name: 5,6,7,8-tetramethoxy-4-methyl-1H-quinolin-2-one
Create Date: 2009-06-25
CID: 42618034

1979. 6,7,8-Trimethoxy-1,4-dimethylquinolin-2(1H)-one; casimiroin analogue, 1n; CHEMBL492382 ...
MW:     263.289080 g/mol MF: C14H17NO4
IUPAC name: 6,7,8-trimethoxy-1,4-dimethylquinolin-2-one
Create Date: 2009-06-25
CID: 42618033

1980. 6,7,8-Trimethoxy-4-methylquinolin-2(1H)-one; casimiroin analogue, 1m; CHEMBL454226 ...
MW:     249.262500 g/mol MF: C13H15NO4
IUPAC name: 6,7,8-trimethoxy-4-methyl-1H-quinolin-2-one
Create Date: 2009-06-25
CID: 42618032

1981. 6,8-Dimethoxy-1,4-dimethylquinolin-2(1H)-one; casimiroin analogue, 1j; CHEMBL493173 ...
MW:     233.263100 g/mol MF: C13H15NO3
IUPAC name: 6,8-dimethoxy-1,4-dimethylquinolin-2-one
Create Date: 2009-06-25
CID: 42618031

1982. casimiroin analogue, 1i; CHEMBL476126; BDBM29220 ...
MW:     219.236520 g/mol MF: C12H13NO3
IUPAC name: 6,8-dimethoxy-4-methyl-1H-quinolin-2-one
Create Date: 2009-06-25
CID: 42618030

1983. 7,8-Dimethoxy-1,4-dimethylquinolin-2(1H)-one; casimiroin analogue, 1h; CHEMBL453233 ...
MW:     233.263100 g/mol MF: C13H15NO3
IUPAC name: 7,8-dimethoxy-1,4-dimethylquinolin-2-one
Create Date: 2009-06-25
CID: 42618029

1984. casimiroin analogue, 1g; CHEMBL503538; BDBM29218 ...
MW:     219.236520 g/mol MF: C12H13NO3
IUPAC name: 7,8-dimethoxy-4-methyl-1H-quinolin-2-one
Create Date: 2009-06-25
CID: 42618028

1985. 6,9-Dimethyl-[1,3]dioxolo[4,5-h]quinolin-8(9H)-one; 1137557-69-7; casimiroin analogue, 1b ...
MW:     217.220640 g/mol MF: C12H11NO3
IUPAC name: 6,9-dimethyl-[1,3]dioxolo[4,5-h]quinolin-8-one
Create Date: 2009-06-25
CID: 42618027

1986. 6-Methyl-[1,3]dioxolo[4,5-h]quinolin-8(9H)-one; 1137557-67-5; casimiroin analogue, 1a ...
MW:     203.194060 g/mol MF: C11H9NO3
IUPAC name: 6-methyl-9H-[1,3]dioxolo[4,5-h]quinolin-8-one
Create Date: 2009-06-25
CID: 42618026

1987. Benzonitrile analogue, 5d; BDBM86784; ZINC19806737 ...
MW:     235.280520 g/mol MF: C16H13NO
IUPAC name: 3-[(E)-3-phenylprop-2-enoxy]benzonitrile
Create Date: 2009-05-28
CID: 28369822

1988. Benzonitrile analogue, 5c; BDBM86783; ZINC19806735 ...
MW:     235.280520 g/mol MF: C16H13NO
IUPAC name: 4-[(E)-3-phenylprop-2-enoxy]benzonitrile
Create Date: 2009-05-28
CID: 28369820

1989. aminophenol analogue, 16; CHEMBL475316; BDBM27768 ...
MW:     349.383160 g/mol MF: C20H19N3O3
IUPAC name: N-(2-hydroxy-5-methoxyphenyl)-4-[(pyridin-4-ylamino)methyl]b...
Create Date: 2009-04-13
CID: 25218553

1990. aminophenol analogue, 15; CHEMBL516400; BDBM27767 ...
MW:     319.357180 g/mol MF: C19H17N3O2
IUPAC name: N-(2-hydroxyphenyl)-4-[(pyridin-4-ylamino)methyl]benzamide
Create Date: 2009-04-13
CID: 25218552

1991. aminophenol analogue, 14; CHEMBL474099; BDBM27766 ...
MW:     398.253240 g/mol MF: C19H16BrN3O2
IUPAC name: N-(5-bromo-2-hydroxyphenyl)-4-[(pyridin-4-ylamino)methyl]ben...
Create Date: 2009-04-13
CID: 25218551

1992. aminophenol analogue, 13; CHEMBL451205; BDBM27765 ...
MW:     337.347643 g/mol MF: C19H16FN3O2
IUPAC name: N-(5-fluoro-2-hydroxyphenyl)-4-[(pyridin-4-ylamino)methyl]be...
Create Date: 2009-04-13
CID: 25218550

1993. aminophenol analogue, 12; CHEMBL473901; BDBM27764 ...
MW:     353.802240 g/mol MF: C19H16ClN3O2
IUPAC name: N-(5-chloro-2-hydroxyphenyl)-4-[(pyridin-4-ylamino)methyl]be...
Create Date: 2009-04-13
CID: 25218549

1994. aminophenol analogue, 11; CHEMBL475099; BDBM27763 ...
MW:     333.383760 g/mol MF: C20H19N3O2
IUPAC name: N-(2-hydroxy-5-methylphenyl)-4-[(pyridin-4-ylamino)methyl]be...
Create Date: 2009-04-13
CID: 25218548

1995. aminophenol analogue, 9; CHEMBL472868; BDBM27761 ...
MW:     423.506300 g/mol MF: C27H25N3O2
IUPAC name: N-(2-hydroxy-5-phenylphenyl)-4-[(1-pyridin-4-ylethylamino)me...
Create Date: 2009-04-13
CID: 25218547

1996. hydroxamate analogue, 5; CHEMBL443075; BDBM27757 ...
MW:     248.320800 g/mol MF: C14H20N2O2
IUPAC name: 4-[(cyclohexylamino)methyl]-N-hydroxybenzamide
Create Date: 2009-04-13
CID: 25218546

1997. hydroxamate analogue, 4; CHEMBL508797; BDBM27756 ...
MW:     276.718220 g/mol MF: C14H13ClN2O2
IUPAC name: 4-[(4-chloroanilino)methyl]-N-hydroxybenzamide
Create Date: 2009-04-13
CID: 25218545

1998. hydroxamate analogue, 3; CHEMBL472861; BDBM27755 ...
MW:     304.771380 g/mol MF: C16H17ClN2O2
IUPAC name: 4-[[2-(3-chlorophenyl)ethylamino]methyl]-N-hydroxybenzamide
Create Date: 2009-04-13
CID: 25218544

1999. hydroxamate analogue, 2; CHEMBL472664; BDBM27754 ...
MW:     286.325720 g/mol MF: C16H18N2O3
IUPAC name: N-hydroxy-4-[[(3-methoxyphenyl)methylamino]methyl]benzamide
Create Date: 2009-04-13
CID: 25218543

2000. hydroxamate analogue, 1; CHEMBL472663; BDBM27753 ...
MW:     290.744800 g/mol MF: C15H15ClN2O2
IUPAC name: 4-[[(3-chlorophenyl)methylamino]methyl]-N-hydroxybenzamide
Create Date: 2009-04-13
CID: 25218542

2001. CHEMBL443077; 3-(4-aminophenyl)quinoxaline-5-carboxamide; quinoxaline analogue, 3f ...
MW:     264.281980 g/mol MF: C15H12N4O
IUPAC name: 3-(4-aminophenyl)quinoxaline-5-carboxamide
Create Date: 2009-04-13
CID: 25218519

2002. CHEMBL481603; 3-(4-cyanophenyl)quinoxaline-5-carboxamide; quinoxaline analogue, 3c ...
MW:     274.276800 g/mol MF: C16H10N4O
IUPAC name: 3-(4-cyanophenyl)quinoxaline-5-carboxamide
Create Date: 2009-04-13
CID: 25218518

2003. thiazole analogue, 17b; CHEMBL517903; BDBM26734 ...
MW:     539.689400 g/mol MF: C26H25N3O4S3
IUPAC name: N-[4-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]phenyl]-1-thiophe...
Create Date: 2009-03-16
CID: 25188784

2004. quinoline analogue, 16e; CHEMBL460128; BDBM26724 ...
MW:     477.598420 g/mol MF: C25H23N3O3S2
IUPAC name: N-(4-quinolin-2-ylphenyl)-1-thiophen-2-ylsulfonylpiperidine-...
Create Date: 2009-03-16
CID: 25188506

2005. thiazole analogue, 17c; CHEMBL462464; BDBM26735 ...
MW:     544.108480 g/mol MF: C25H22ClN3O3S3
IUPAC name: N-[4-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]phenyl]-1-thiophen...
Create Date: 2009-03-16
CID: 25187969

2006. thiazole analogue, 17a; CHEMBL460129; BDBM26733 ...
MW:     539.689400 g/mol MF: C26H25N3O4S3
IUPAC name: N-[4-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]phenyl]-1-thiophe...
Create Date: 2009-03-16
CID: 25187968

2007. thiazole analogue, 16d; CHEMBL518329; BDBM26723 ...
MW:     433.567460 g/mol MF: C19H19N3O3S3
IUPAC name: N-[4-(1,3-thiazol-2-yl)phenyl]-1-thiophen-2-ylsulfonylpiperi...
Create Date: 2009-03-16
CID: 25187693

2008. Begacestat analogue, 16; CHEMBL443344; BDBM28927 ...
MW:     391.738139 g/mol MF: C9H8ClF6NO3S2
IUPAC name: 5-chloro-N-[(2R)-4,4,4-trifluoro-1-hydroxy-3-(trifluoromethy...
Create Date: 2009-02-23
CID: 25159185

2009. aminophenol analogue, 10; CHEMBL474903; SCHEMBL3645215 ...
MW:     395.453140 g/mol MF: C25H21N3O2
IUPAC name: N-(2-hydroxy-5-phenylphenyl)-4-[(pyridin-4-ylamino)methyl]be...
Create Date: 2009-02-23
CID: 25159052

2010. aminophenol analogue, 8; CHEMBL472671; SCHEMBL3646011 ...
MW:     409.479720 g/mol MF: C26H23N3O2
IUPAC name: N-(2-hydroxy-5-phenylphenyl)-4-[(pyridin-3-ylmethylamino)met...
Create Date: 2009-02-23
CID: 25159049

2011. aminophenol analogue, 7; CHEMBL472670; SCHEMBL3643650 ...
MW:     374.475440 g/mol MF: C24H26N2O2
IUPAC name: N-(2-hydroxy-5-phenylphenyl)-4-[(2-methylpropylamino)methyl]...
Create Date: 2009-02-23
CID: 25158540

2012. aminophenol analogue, 6; CHEMBL474693; SCHEMBL3646492 ...
MW:     422.518240 g/mol MF: C28H26N2O2
IUPAC name: N-(2-hydroxy-5-phenylphenyl)-4-[(2-phenylethylamino)methyl]b...
Create Date: 2009-02-23
CID: 25158538

2013. Piperazine analogue, 38; CHEMBL493307; SCHEMBL17173536 ...
MW:     410.441423 g/mol MF: C22H23FN4O3
IUPAC name: 4-[[4-fluoro-3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]phen...
Create Date: 2009-01-19
CID: 25133629

2014. Piperazine analogue, 37; CHEMBL522501; BDBM27556 ...
MW:     392.450960 g/mol MF: C22H24N4O3
IUPAC name: 4-[[3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]phenyl]methyl...
Create Date: 2009-01-19
CID: 25133283

2015. Piperazine analogue, 36; CHEMBL493306; BDBM27555 ...
MW:     470.494923 g/mol MF: C27H23FN4O3
IUPAC name: 4-[[3-(4-benzoylpiperazine-1-carbonyl)-4-fluorophenyl]methyl...
Create Date: 2009-01-19
CID: 25133282

2016. Piperazine analogue, 35; CHEMBL494117; BDBM27554 ...
MW:     452.504460 g/mol MF: C27H24N4O3
IUPAC name: 4-[[3-(4-benzoylpiperazine-1-carbonyl)phenyl]methyl]-2H-phth...
Create Date: 2009-01-19
CID: 25133281

2017. Piperazine analogue, 34; CHEMBL494929; BDBM27553 ...
MW:     442.484823 g/mol MF: C26H23FN4O2
IUPAC name: 4-[[4-fluoro-3-(4-phenylpiperazine-1-carbonyl)phenyl]methyl]...
Create Date: 2009-01-19
CID: 25133280

2018. Piperazine analogue, 33; CHEMBL494928; BDBM27552 ...
MW:     424.494360 g/mol MF: C26H24N4O2
IUPAC name: 4-[[3-(4-phenylpiperazine-1-carbonyl)phenyl]methyl]-2H-phtha...
Create Date: 2009-01-19
CID: 25133279

2019. Piperazine analogue, 32; CHEMBL494721; BDBM27551 ...
MW:     479.503443 g/mol MF: C25H26FN5O4
IUPAC name: 4-[[4-fluoro-3-[4-(morpholine-4-carbonyl)piperazine-1-carbon...
Create Date: 2009-01-19
CID: 25133278

2020. Piperazine analogue, 31; CHEMBL492470; BDBM27550 ...
MW:     461.512980 g/mol MF: C25H27N5O4
IUPAC name: 4-[[3-[4-(morpholine-4-carbonyl)piperazine-1-carbonyl]phenyl...
Create Date: 2009-01-19
CID: 25132957

2021. Piperazine analogue, 30; CHEMBL493499; BDBM27549 ...
MW:     458.505823 g/mol MF: C22H23FN4O4S
IUPAC name: 4-[[3-(4-ethylsulfonylpiperazine-1-carbonyl)-4-fluorophenyl]...
Create Date: 2009-01-19
CID: 25132956

2022. Piperazine analogue, 29; CHEMBL493498; BDBM27548 ...
MW:     440.515360 g/mol MF: C22H24N4O4S
IUPAC name: 4-[[3-(4-ethylsulfonylpiperazine-1-carbonyl)phenyl]methyl]-2...
Create Date: 2009-01-19
CID: 25132955

2023. Piperazine analogue, 28; CHEMBL523686; BDBM27547 ...
MW:     444.460943 g/mol MF: C24H21FN6O2
IUPAC name: 4-[[4-fluoro-3-(4-pyrimidin-2-ylpiperazine-1-carbonyl)phenyl...
Create Date: 2009-01-19
CID: 25132954

2024. Piperazine analogue, 27; CHEMBL521809; BDBM27546 ...
MW:     426.470480 g/mol MF: C24H22N6O2
IUPAC name: 4-[[3-(4-pyrimidin-2-ylpiperazine-1-carbonyl)phenyl]methyl]-...
Create Date: 2009-01-19
CID: 25132953

2025. Piperazine analogue, 26; CHEMBL523058; BDBM27545 ...
MW:     443.472883 g/mol MF: C25H22FN5O2
IUPAC name: 4-[[4-fluoro-3-(4-pyridin-2-ylpiperazine-1-carbonyl)phenyl]m...
Create Date: 2009-01-19
CID: 25132952

2026. Piperazine analogue, 25; CHEMBL495497; BDBM27544 ...
MW:     425.482420 g/mol MF: C25H23N5O2
IUPAC name: 4-[[3-(4-pyridin-2-ylpiperazine-1-carbonyl)phenyl]methyl]-2H...
Create Date: 2009-01-19
CID: 25132613

2027. CHEMBL201616; Piperazine, 1-[3-[(3,4-dihydro-4-oxo-1-phthalazinyl)methyl]benzoyl]-; 763111-46-2 ...
MW:     348.398400 g/mol MF: C20H20N4O2
IUPAC name: 4-[[3-(piperazine-1-carbonyl)phenyl]methyl]-2H-phthalazin-1-...
Create Date: 2009-01-19
CID: 25132612

2028. benzyl amide analog., 9; CHEMBL270219; SCHEMBL4863522 ...
MW:     383.442440 g/mol MF: C24H21N3O2
IUPAC name: N-benzyl-4-[2-methyl-5-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl...
Create Date: 2008-12-11
CID: 25093465

2029. phenyl amide analog., 7; CHEMBL408476; SCHEMBL4856421 ...
MW:     462.520880 g/mol MF: C24H22N4O4S
IUPAC name: N-[4-(methanesulfonamido)phenyl]-4-[2-methyl-5-(5-methyl-1,3...
Create Date: 2008-12-11
CID: 25093464

2030. phenyl amide analog., 6; CHEMBL272566; SCHEMBL4858353 ...
MW:     426.467180 g/mol MF: C25H22N4O3
IUPAC name: N-methyl-3-[[4-[2-methyl-5-(5-methyl-1,3,4-oxadiazol-2-yl)ph...
Create Date: 2008-12-11
CID: 25093463

2031. phenyl amide analog., 5; CHEMBL272565; BDBM25984 ...
MW:     399.441840 g/mol MF: C24H21N3O3
IUPAC name: N-(2-methoxyphenyl)-4-[2-methyl-5-(5-methyl-1,3,4-oxadiazol-...
Create Date: 2008-12-11
CID: 25093462

2032. phenyl amide analog., 2; CHEMBL401538; SCHEMBL6487595 ...
MW:     467.562160 g/mol MF: C28H29N5O2
IUPAC name: 4-[2-methyl-5-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-N-[3-(4...
Create Date: 2008-12-11
CID: 25093461

2033. aminothiazole analogue, 9; SCHEMBL14066777; BDBM25665 ...
MW:     381.030810 g/mol MF: C9H6BrIN2S
IUPAC name: 5-bromo-N-(4-iodophenyl)-1,3-thiazol-2-amine
Create Date: 2008-12-11
CID: 25093332

2034. aminothiazole analogue, 5; SCHEMBL4888854; BDBM25661 ...
MW:     287.151323 g/mol MF: C10H8BrFN2S
IUPAC name: 5-bromo-N-(4-fluorophenyl)-N-methyl-1,3-thiazol-2-amine
Create Date: 2008-12-11
CID: 25093331

2035. aminothiazole analogue, 1; SCHEMBL2981886; BDBM25656 ...
MW:     194.228683 g/mol MF: C9H7FN2S
IUPAC name: N-(4-fluorophenyl)-1,3-thiazol-2-amine
Create Date: 2008-12-11
CID: 25093329

2036. Conessine analogue, 13d; CHEMBL510825; SCHEMBL14184400 ...
MW:     497.755540 g/mol MF: C31H51N3O2
Create Date: 2008-11-24
CID: 25053489

2037. Conessine analogue, 13b; CHEMBL510387; SCHEMBL14184388 ...
MW:     455.718860 g/mol MF: C29H49N3O
Create Date: 2008-11-24
CID: 25053488

2038. Conessine analogue, 12l; CHEMBL453878; BDBM27206 ...
MW:     482.720980 g/mol MF: C29H42N2O2S
Create Date: 2008-11-24
CID: 25053487

2039. Conessine analogue, 12j; CHEMBL455401; BDBM27204 ...
MW:     449.692820 g/mol MF: C25H43N3O2S
Create Date: 2008-11-24
CID: 25053486

2040. Conessine analogue, 12h; CHEMBL509205; SCHEMBL14184476 ...
MW:     400.597300 g/mol MF: C25H40N2O2
Create Date: 2008-11-24
CID: 25053485

2041. Conessine analogue, 12e; CHEMBL454425; BDBM27199 ...
MW:     447.655340 g/mol MF: C29H41N3O
Create Date: 2008-11-24
CID: 25053425

2042. Conessine analogue, 12c; CHEMBL455645; BDBM27197 ...
MW:     446.667280 g/mol MF: C30H42N2O
Create Date: 2008-11-24
CID: 25053424

2043. Conessine analogue, 12a; CHEMBL488210; BDBM27195 ...
MW:     384.597900 g/mol MF: C25H40N2O
Create Date: 2008-11-24
CID: 25053423

2044. Conessine analogue, 13e; CHEMBL502704; BDBM27212 ...
MW:     531.771760 g/mol MF: C34H49N3O2
Create Date: 2008-11-24
CID: 25053421

2045. Conessine analogue, 13c; CHEMBL451821; BDBM27210 ...
MW:     455.718860 g/mol MF: C29H49N3O
Create Date: 2008-11-24
CID: 25053351

2046. Conessine analogue, 12m; CHEMBL454108; BDBM27207 ...
MW:     507.730440 g/mol MF: C30H41N3O2S
Create Date: 2008-11-24
CID: 25053350

2047. Conessine analogue, 12k; CHEMBL508478; BDBM27205 ...
MW:     434.678180 g/mol MF: C25H42N2O2S
Create Date: 2008-11-24
CID: 25053349

2048. Conessine analogue, 12i; CHEMBL455400; BDBM27203 ...
MW:     413.639120 g/mol MF: C26H43N3O
Create Date: 2008-11-24
CID: 25053348

2049. Conessine analogue, 12g; CHEMBL454664; SCHEMBL14184409 ...
MW:     443.666640 g/mol MF: C30H41N3
Create Date: 2008-11-24
CID: 25053347

2050. Conessine analogue, 12f; CHEMBL507565; SCHEMBL14255822 ...
MW:     466.721580 g/mol MF: C29H42N2OS
Create Date: 2008-11-24
CID: 25053286

2051. Conessine analogue, 12d; CHEMBL510426; BDBM27198 ...
MW:     471.676740 g/mol MF: C31H41N3O
Create Date: 2008-11-24
CID: 25053285

2052. Conessine analogue, 12b; CHEMBL455644; BDBM27196 ...
MW:     410.635180 g/mol MF: C27H42N2O
Create Date: 2008-11-24
CID: 25053284

2053. 4-pyridone analogue, 3; CHEMBL454356; BDBM24449 ...
MW:     458.416346 g/mol MF: C25H16F2N4O3
IUPAC name: 5-(4-fluorophenyl)-N-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4...
Create Date: 2008-09-22
CID: 24901682

2054. THC-CoA Analogue, 7; BDBM21731
MW:    1218.160449 g/mol MF: C48H79FN7O20P3S
IUPAC name: S-[2-[3-[[4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy...
Create Date: 2008-05-08
CID: 24776373

2055. Pyrimidine analogue, 40; CHEMBL271202; SCHEMBL1489441 ...
MW:     412.511860 g/mol MF: C19H24N8OS
IUPAC name: N-[6-(3,5-dimethylpyrazol-1-yl)-2-(1,3-thiazol-2-yl)pyrimidi...
Create Date: 2008-04-23
CID: 24768413

2056. Pyrimidine analogue, 39; CHEMBL409711; SCHEMBL1489670 ...
MW:     406.484140 g/mol MF: C21H26N8O
IUPAC name: N-[6-(3,5-dimethylpyrazol-1-yl)-2-pyridin-2-ylpyrimidin-4-yl...
Create Date: 2008-04-23
CID: 24768412

2057. Pyrimidine analogue, 38; CHEMBL409934; SCHEMBL1489790 ...
MW:     378.430980 g/mol MF: C19H22N8O
IUPAC name: 2-(4-methylpiperazin-1-yl)-N-(6-pyrazol-1-yl-2-pyridin-2-ylp...
Create Date: 2008-04-23
CID: 24768411

2058. Pyrimidine analogue, 37; CHEMBL271377; SCHEMBL1489482 ...
MW:     384.458700 g/mol MF: C17H20N8OS
IUPAC name: 2-(4-methylpiperazin-1-yl)-N-[6-pyrazol-1-yl-2-(1,3-thiazol-...
Create Date: 2008-04-23
CID: 24768410

2059. Pyrimidine analogue, 36; CHEMBL272889; BDBM21184 ...
MW:     410.472840 g/mol MF: C20H26N8O2
IUPAC name: N-[2-(3,5-dimethylpyrazol-1-yl)-6-(4-methyl-1,3-oxazol-5-yl)...
Create Date: 2008-04-23
CID: 24768409

2060. Pyrimidine analogue, 35; CHEMBL407711; BDBM21183 ...
MW:     396.446260 g/mol MF: C19H24N8O2
IUPAC name: N-[2-(3,5-dimethylpyrazol-1-yl)-6-(1,3-oxazol-5-yl)pyrimidin...
Create Date: 2008-04-23
CID: 24768408

2061. CHEMBL270761; Pyrimidine analogue, 34; BDBM21182 ...
MW:     412.511860 g/mol MF: C19H24N8OS
IUPAC name: N-[2-(3,5-dimethylpyrazol-1-yl)-6-(1,3-thiazol-2-yl)pyrimidi...
Create Date: 2008-04-23
CID: 24768407

2062. Pyrimidine analogue, 33; CHEMBL270715; SCHEMBL1489955 ...
MW:     367.408340 g/mol MF: C17H21N9O
IUPAC name: N-[2,6-di(pyrazol-1-yl)pyrimidin-4-yl]-2-(4-methylpiperazin-...
Create Date: 2008-04-23
CID: 24768406

2063. Pyrimidine analogue, 32; CHEMBL270136; SCHEMBL1489615 ...
MW:     394.493280 g/mol MF: C20H22N6OS
IUPAC name: 2-(4-methylpiperazin-1-yl)-N-(6-pyridin-2-yl-2-thiophen-2-yl...
Create Date: 2008-04-23
CID: 24768405

2064. Pyrimidine analogue, 30; JMC511730 Compound 1; CHEMBL270467 ...
MW:     409.484780 g/mol MF: C21H27N7O2
IUPAC name: N-[6-(3,5-dimethylpyrazol-1-yl)-2-(5-methylfuran-2-yl)pyrimi...
Create Date: 2008-04-23
CID: 24768404

2065. Pyrimidine analogue, 29; CHEMBL272825; BDBM21177 ...
MW:     395.458200 g/mol MF: C20H25N7O2
IUPAC name: N-[2-(5-methylfuran-2-yl)-6-(5-methylpyrazol-1-yl)pyrimidin-...
Create Date: 2008-04-23
CID: 24768403

2066. Pyrimidine analogue, 28; CHEMBL409112; SCHEMBL1489704 ...
MW:     381.431620 g/mol MF: C19H23N7O2
IUPAC name: N-[2-(5-methylfuran-2-yl)-6-pyrazol-1-ylpyrimidin-4-yl]-2-(4...
Create Date: 2008-04-23
CID: 24768402

2067. CHEMBL252171; N-(6-(3,5-dimethyl-1H-pyrazol-1-yl)-2-(furan-2-yl)pyrimidin-4-yl)-2-(4-methylpiperazin-1-yl)acetamide; N-[6-(3,5-dimethyl-1H-pyrazol-1-yl)-2-(furan-2-yl)pyrimidin-4-yl]-2-(4-methylpiperazin-1-yl)acetamide ...
MW:     395.458200 g/mol MF: C20H25N7O2
IUPAC name: N-[6-(3,5-dimethylpyrazol-1-yl)-2-(furan-2-yl)pyrimidin-4-yl...
Create Date: 2008-04-23
CID: 24768401

2068. CHEMBL398272; Pyrimidine analogue, 26; SCHEMBL1489612 ...
MW:     384.455400 g/mol MF: C18H20N6O2S
IUPAC name: N-[2-(furan-2-yl)-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]-2-(4-m...
Create Date: 2008-04-23
CID: 24768400

2069. Urea-based Analogue, 6; CHEMBL255036; BDBM20729 ...
MW:     428.479760 g/mol MF: C26H24N2O4
IUPAC name: (1S,2R)-2-[4-[4-(phenylcarbamoylamino)phenyl]benzoyl]cyclope...
Create Date: 2008-04-23
CID: 24768273

2070. Urea-based Analogue, 5; CHEMBL254824; BDBM20728 ...
MW:     428.479760 g/mol MF: C26H24N2O4
IUPAC name: (1S,2S)-2-[4-[4-(phenylcarbamoylamino)phenyl]benzoyl]cyclope...
Create Date: 2008-04-23
CID: 24768272

2071. Urea-based Analogue, 4k; CHEMBL402926; SCHEMBL4894234 ...
MW:     472.489260 g/mol MF: C27H24N2O6
IUPAC name: (1R,2R)-2-[4-[4-(1,3-benzodioxol-5-ylcarbamoylamino)phenyl]b...
Create Date: 2008-04-23
CID: 24768271

2072. Urea-based Analogue, 4j; CHEMBL402721; SCHEMBL4885327 ...
MW:     496.477730 g/mol MF: C27H23F3N2O4
IUPAC name: (1R,2R)-2-[4-[4-[[4-(trifluoromethyl)phenyl]carbamoylamino]p...
Create Date: 2008-04-23
CID: 24768270

2073. Urea-based Analogue, 4i; CHEMBL254871; SCHEMBL4892461 ...
MW:     453.489220 g/mol MF: C27H23N3O4
IUPAC name: (1R,2R)-2-[4-[4-[(4-cyanophenyl)carbamoylamino]phenyl]benzoy...
Create Date: 2008-04-23
CID: 24768269

2074. Urea-based Analogue, 4h; SCHEMBL4886805; BDBM20724 ...
MW:     458.505740 g/mol MF: C27H26N2O5
IUPAC name: (1R,2R)-2-[4-[4-[(4-methoxyphenyl)carbamoylamino]phenyl]benz...
Create Date: 2008-04-23
CID: 24768268

2075. Urea-based Analogue, 4g; CHEMBL253610; BDBM20723 ...
MW:     485.531080 g/mol MF: C28H27N3O5
IUPAC name: (1R,2R)-2-[4-[4-[[3-(methylcarbamoyl)phenyl]carbamoylamino]p...
Create Date: 2008-04-23
CID: 24768267

2076. Urea-based Analogue, 4f; CHEMBL254865; SCHEMBL4890035 ...
MW:     514.468193 g/mol MF: C27H22F4N2O4
IUPAC name: (1R,2R)-2-[4-[4-[[2-fluoro-5-(trifluoromethyl)phenyl]carbamo...
Create Date: 2008-04-23
CID: 24768266

2077. Urea-based Analogue, 4e; CHEMBL404419; SCHEMBL4883194 ...
MW:     462.924820 g/mol MF: C26H23ClN2O4
IUPAC name: (1R,2R)-2-[4-[4-[(3-chlorophenyl)carbamoylamino]phenyl]benzo...
Create Date: 2008-04-23
CID: 24768265

2078. Urea-based Analogue, 4d; CHEMBL254658; SCHEMBL4892114 ...
MW:     446.470223 g/mol MF: C26H23FN2O4
IUPAC name: (1R,2R)-2-[4-[4-[(3-fluorophenyl)carbamoylamino]phenyl]benzo...
Create Date: 2008-04-23
CID: 24768264

2079. Urea-based Analogue, 4c; CHEMBL254445; SCHEMBL4890955 ...
MW:     496.477730 g/mol MF: C27H23F3N2O4
IUPAC name: (1R,2R)-2-[4-[4-[[3-(trifluoromethyl)phenyl]carbamoylamino]p...
Create Date: 2008-04-23
CID: 24768263

2080. Urea-based Analogue, 4b; CHEMBL254444; SCHEMBL4890716 ...
MW:     496.477730 g/mol MF: C27H23F3N2O4
IUPAC name: (1R,2R)-2-[4-[4-[[2-(trifluoromethyl)phenyl]carbamoylamino]p...
Create Date: 2008-04-23
CID: 24768262

2081. 959122-11-3; A 922500; A922500 ...
MW:     428.479760 g/mol MF: C26H24N2O4
IUPAC name: (1R,2R)-2-[4-[4-(phenylcarbamoylamino)phenyl]benzoyl]cyclope...
Create Date: 2008-04-23
CID: 24768261

2082. thiolate analogue, 13a; CHEMBL235262; BDBM19132
MW:     428.587480 g/mol MF: C24H32N2O3S
IUPAC name: tert-butyl N-[(2S)-1-oxo-1-(3-phenylanilino)-7-sulfanylhepta...
Create Date: 2008-01-19
CID: 23648185

2083. open-chain analog 104; CHEMBL211384; BDBM16078 ...
MW:     498.699000 g/mol MF: C26H50N4O5
IUPAC name: (2R,4S,5S)-5-[[(2S)-2-[[(2S)-2-acetamido-4-methylpentanoyl]-...
Create Date: 2008-01-19
CID: 23647296

2084. open-chain analog 103; CHEMBL209795; BDBM16077 ...
MW:     484.672420 g/mol MF: C25H48N4O5
IUPAC name: (2R,4S,5S)-5-[[(2S)-2-[[(2S)-2-acetamido-4-methylpentanoyl]a...
Create Date: 2008-01-19
CID: 23647295

2085. 5-azaindole analog 34; CHEMBL208951; BDBM14896 ...
MW:     464.515160 g/mol MF: C28H24N4O3
IUPAC name: 1-benzyl-1-hydroxy-3-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyri...
Create Date: 2008-01-19
CID: 23646883

2086. 5-azaindole analog 32; CHEMBL378108; BDBM14894 ...
MW:     449.500520 g/mol MF: C28H23N3O3
IUPAC name: 2-hydroxy-N-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyridin-2-yl)...
Create Date: 2008-01-19
CID: 23646881

2087. 5-azaindole analog 31; CHEMBL207393; BDBM14893 ...
MW:     464.515160 g/mol MF: C28H24N4O3
IUPAC name: 3-hydroxy-N-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyridin-2-yl)...
Create Date: 2008-01-19
CID: 23646880

2088. 5-azaindole analog 30; CHEMBL379809; BDBM14892 ...
MW:     463.527100 g/mol MF: C29H25N3O3
IUPAC name: 3-hydroxy-N-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyridin-2-yl)...
Create Date: 2008-01-19
CID: 23646879

2089. 5-azaindole analog 29; CHEMBL209989; BDBM14891 ...
MW:     469.482046 g/mol MF: C28H21F2N3O2
IUPAC name: 2-(2,6-difluorophenyl)-N-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]...
Create Date: 2008-01-19
CID: 23646878

2090. 5-azaindole analog 28; CHEMBL210508; BDBM14890 ...
MW:     433.501120 g/mol MF: C28H23N3O2
IUPAC name: N-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyridin-2-yl)phenyl]phe...
Create Date: 2008-01-19
CID: 23646877

2091. 5-azaindole analog 27; CHEMBL210678; BDBM14889 ...
MW:     441.524880 g/mol MF: C26H27N5O2
IUPAC name: N-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyridin-2-yl)phenyl]phe...
Create Date: 2008-01-19
CID: 23646876

2092. 5-azaindole analog 26; CHEMBL210563; BDBM14888 ...
MW:     412.483660 g/mol MF: C25H24N4O2
IUPAC name: N-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyridin-2-yl)phenyl]phe...
Create Date: 2008-01-19
CID: 23646875

2093. 5-azaindole analog 25; CHEMBL210633; BDBM14887 ...
MW:     435.477240 g/mol MF: C26H21N5O2
IUPAC name: 1-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyridin-2-yl)phenyl]phe...
Create Date: 2008-01-19
CID: 23646874

2094. 5-azaindole analog 24; CHEMBL209772; BDBM14886 ...
MW:     435.477240 g/mol MF: C26H21N5O2
IUPAC name: 1-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyridin-2-yl)phenyl]phe...
Create Date: 2008-01-19
CID: 23646873

2095. 5-azaindole analog 23; CHEMBL377368; BDBM14885 ...
MW:     440.516900 g/mol MF: C25H20N4O2S
IUPAC name: 1-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyridin-2-yl)phenyl]phe...
Create Date: 2008-01-19
CID: 23646872

2096. 5-azaindole analog 22; CHEMBL206310; BDBM14884 ...
MW:     440.516900 g/mol MF: C25H20N4O2S
IUPAC name: 1-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyridin-2-yl)phenyl]phe...
Create Date: 2008-01-19
CID: 23646871

2097. 5-azaindole analog 21; CHEMBL207036; BDBM14883 ...
MW:     478.498680 g/mol MF: C28H22N4O4
IUPAC name: 4-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyridin-2-yl)phenyl]phe...
Create Date: 2008-01-19
CID: 23646870

2098. 5-azaindole analog 20; CHEMBL207035; BDBM14882 ...
MW:     476.525860 g/mol MF: C29H24N4O3
IUPAC name: 1-(4-acetylphenyl)-3-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyri...
Create Date: 2008-01-19
CID: 23646869

2099. 5-azaindole analog 19; CHEMBL210902; BDBM14881 ...
MW:     476.525860 g/mol MF: C29H24N4O3
IUPAC name: 1-(3-acetylphenyl)-3-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyri...
Create Date: 2008-01-19
CID: 23646868

2100. 5-azaindole analog 18; CHEMBL379552; BDBM14880 ...
MW:     494.541140 g/mol MF: C29H26N4O4
IUPAC name: 1-(2,4-dimethoxyphenyl)-3-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c...
Create Date: 2008-01-19
CID: 23646867

2101. 5-azaindole analog 17; CHEMBL209833; BDBM14879 ...
MW:     464.515160 g/mol MF: C28H24N4O3
IUPAC name: 1-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyridin-2-yl)phenyl]phe...
Create Date: 2008-01-19
CID: 23646866

2102. 5-azaindole analog 16; CHEMBL377692; BDBM14878 ...
MW:     464.515160 g/mol MF: C28H24N4O3
IUPAC name: 1-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyridin-2-yl)phenyl]phe...
Create Date: 2008-01-19
CID: 23646865

2103. 5-azaindole analog 15; CHEMBL210152; BDBM14877 ...
MW:     464.515160 g/mol MF: C28H24N4O3
IUPAC name: 1-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyridin-2-yl)phenyl]phe...
Create Date: 2008-01-19
CID: 23646864

2104. 5-azaindole analog 14; CHEMBL210739; BDBM14876 ...
MW:     468.934240 g/mol MF: C27H21ClN4O2
IUPAC name: 1-(2-chlorophenyl)-3-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]pyri...
Create Date: 2008-01-19
CID: 23646863

2105. 5-azaindole analog 13; CHEMBL210219; BDBM14875 ...
MW:     470.470106 g/mol MF: C27H20F2N4O2
IUPAC name: 1-(3,5-difluorophenyl)-3-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]...
Create Date: 2008-01-19
CID: 23646862

2106. 5-azaindole analog 12; CHEMBL210489; BDBM14874 ...
MW:     470.470106 g/mol MF: C27H20F2N4O2
IUPAC name: 1-(3,4-difluorophenyl)-3-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]...
Create Date: 2008-01-19
CID: 23646861

2107. 5-azaindole analog 11; CHEMBL377110; BDBM14873 ...
MW:     470.470106 g/mol MF: C27H20F2N4O2
IUPAC name: 1-(2,4-difluorophenyl)-3-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]...
Create Date: 2008-01-19
CID: 23646860

2108. N-pyrazinylurea Analog 7; Chk1_76; CHEMBL207596 ...
MW:     318.718440 g/mol MF: C13H11ClN6O2
IUPAC name: 1-(4-amino-5-chloro-2-methoxyphenyl)-3-(5-cyanopyrazin-2-yl)...
Create Date: 2008-01-19
CID: 23646791

2109. N-pyrazinylurea Analog 6; CHEMBL206139; BDBM14604 ...
MW:     348.701360 g/mol MF: C13H9ClN6O4
IUPAC name: 1-(5-chloro-2-methoxy-4-nitrophenyl)-3-(5-cyanopyrazin-2-yl)...
Create Date: 2008-01-19
CID: 23646790

2110. 2-quinolone analog 25b; CHEMBL195843; BDBM14449 ...
MW:     542.028020 g/mol MF: C30H28ClN5O3
IUPAC name: 4-(3-chlorophenyl)-1-methyl-6-[[5-[[3-(morpholine-4-carbonyl...
Create Date: 2008-01-19
CID: 23646775

2111. 2-quinolone analog 25a; CHEMBL370049; BDBM14448 ...
MW:     453.922900 g/mol MF: C26H20ClN5O
IUPAC name: 1-[[3-[[4-(3-chlorophenyl)-1-methyl-2-oxoquinolin-6-yl]methy...
Create Date: 2008-01-19
CID: 23646774

2112. 2-quinolone analog 24; CHEMBL195730; BDBM14447 ...
MW:     456.923540 g/mol MF: C26H21ClN4O2
IUPAC name: 4-(3-chlorophenyl)-1-methyl-6-[[5-[(4-oxopyridin-1-yl)methyl...
Create Date: 2008-01-19
CID: 23646773

2113. 2-quinolone analog 22; CHEMBL193881; BDBM14446 ...
MW:     494.971520 g/mol MF: C29H23ClN4O2
IUPAC name: 4-[[3-[[4-(3-chlorophenyl)-1-methyl-2-oxoquinolin-6-yl]methy...
Create Date: 2008-01-19
CID: 23646772

2114. 2-quinolone analog 21; CHEMBL194382; BDBM14445 ...
MW:     480.944940 g/mol MF: C28H21ClN4O2
IUPAC name: 4-[[3-[[4-(3-chlorophenyl)-1-methyl-2-oxoquinolin-6-yl]methy...
Create Date: 2008-01-19
CID: 23646771

2115. 2-quinolone analog 27; CHEMBL364067; BDBM14442 ...
MW:     494.971520 g/mol MF: C29H23ClN4O2
IUPAC name: 4-[[4-(3-chlorophenyl)-1-methyl-2-oxoquinolin-6-yl]methoxy-(...
Create Date: 2008-01-19
CID: 23646768

2116. 2-quinolone analog 26; CHEMBL195553; SCHEMBL1758019 ...
MW:     494.971520 g/mol MF: C29H23ClN4O2
IUPAC name: 4-[[5-[[4-(3-chlorophenyl)-1-methyl-2-oxoquinolin-6-yl]metho...
Create Date: 2008-01-19
CID: 23646767

2117. benzimidazolone analog 8; CHEMBL2096825; BDBM14432 ...
MW:     479.357900 g/mol MF: C25H20Cl2N4O2
IUPAC name: 1-(3-chlorophenyl)-5-[(4-chlorophenyl)-hydroxy-(3-methylimid...
Create Date: 2008-01-19
CID: 23646761

2118. benzimidazolone analog 2j; CHEMBL426274; BDBM14426 ...
MW:     494.971520 g/mol MF: C29H23ClN4O2
IUPAC name: 5-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-1...
Create Date: 2008-01-19
CID: 23646755

2119. benzimidazolone analog 2i; CHEMBL363823; BDBM14425 ...
MW:     479.486740 g/mol MF: C27H21N5O4
IUPAC name: 4-[[3-(1,3-benzodioxol-5-yl)-1-methyl-2-oxobenzimidazol-5-yl...
Create Date: 2008-01-19
CID: 23646754

2120. benzimidazolone analog 2h; CHEMBL364506; BDBM14424 ...
MW:     488.922340 g/mol MF: C26H21ClN4O4
IUPAC name: 3-(1,3-benzodioxol-5-yl)-5-[(4-chlorophenyl)-hydroxy-(3-meth...
Create Date: 2008-01-19
CID: 23646753

2121. benzimidazolone analog 2f; CHEMBL383797; BDBM14422 ...
MW:     488.965400 g/mol MF: C27H25ClN4O3
IUPAC name: 5-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-3...
Create Date: 2008-01-19
CID: 23646752

2122. benzimidazolone analog 2e; CHEMBL383579; BDBM14421 ...
MW:     465.503220 g/mol MF: C27H23N5O3
IUPAC name: 4-[hydroxy-[3-(3-methoxyphenyl)-1-methyl-2-oxobenzimidazol-5...
Create Date: 2008-01-19
CID: 23646751

2123. benzimidazolone analog 2d; CHEMBL435915; BDBM14420 ...
MW:     474.938820 g/mol MF: C26H23ClN4O3
IUPAC name: 5-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-3...
Create Date: 2008-01-19
CID: 23646750

2124. benzimidazolone analog 2b; CHEMBL197555; BDBM14418 ...
MW:     570.809370 g/mol MF: C25H20ClIN4O2
IUPAC name: 3-(3-chlorophenyl)-5-[hydroxy-(4-iodophenyl)-(3-methylimidaz...
Create Date: 2008-01-19
CID: 23646749

2125. benzimidazolone analog 2a; CHEMBL372514; BDBM14417 ...
MW:     479.357900 g/mol MF: C25H20Cl2N4O2
IUPAC name: 3-(3-chlorophenyl)-5-[(4-chlorophenyl)-hydroxy-(3-methylimid...
Create Date: 2008-01-19
CID: 23646748

2126. imidazopyridine analog 4; CHEMBL426676; BDBM13780 ...
MW:     405.363600 g/mol MF: C20H15N5O5
IUPAC name: 2-[(3E)-3-(5-amino-1,3-dihydroimidazo[4,5-b]pyridin-2-yliden...
Create Date: 2008-01-19
CID: 23646501

2127. CHEMBL84624; benzothiazole analog 13; BDBM13356 ...
MW:     423.918520 g/mol MF: C21H18ClN5OS
IUPAC name: N-(2-chloro-6-methylphenyl)-2-[(2,6-dimethylpyrimidin-4-yl)a...
Create Date: 2008-01-19
CID: 23646368

2128. arylsulfonamide analogue 7; BDBM12045; (3S)-3-benzenesulfonamido-4-oxo-9-phenylnonanoic acid ...
MW:     403.491900 g/mol MF: C21H25NO5S
IUPAC name: (3S)-3-(benzenesulfonamido)-4-oxo-9-phenylnonanoic acid
Create Date: 2008-01-19
CID: 23645962

2129. Saxagliptin analogue 30; CHEMBL3350937; SCHEMBL14899590 ...
MW:     317.401063 g/mol MF: C18H24FN3O
IUPAC name: (1S,3S,5S)-2-[(2S)-2-amino-2-(3-fluoro-1-adamantyl)acetyl]-2...
Create Date: 2008-01-19
CID: 23645680

2130. 5-Hydroxy saxagliptin; 841302-24-7; Saxagliptin analogue 28 ...
MW:     331.409400 g/mol MF: C18H25N3O3
IUPAC name: (1S,3S,5S)-2-[(2S)-2-amino-2-(3,5-dihydroxy-1-adamantyl)acet...
Create Date: 2008-01-19
CID: 23645678

2131. thiolate analogue, 40a; CHEMBL236129; BDBM19148 ...
MW:     378.528800 g/mol MF: C20H30N2O3S
IUPAC name: benzyl N-[(2S)-1-(cyclopentylamino)-1-oxo-7-sulfanylheptan-2...
Create Date: 2008-01-07
CID: 23635017

2132. thiolate analogue, 38a; CHEMBL391396; BDBM19147 ...
MW:     370.549860 g/mol MF: C19H34N2O3S
IUPAC name: cyclohexyl N-[(2S)-1-(cyclopentylamino)-1-oxo-7-sulfanylhept...
Create Date: 2008-01-07
CID: 23635016

2133. thiolate analogue, 37a; CHEMBL236128; BDBM19146 ...
MW:     302.432840 g/mol MF: C14H26N2O3S
IUPAC name: methyl N-[(2S)-1-(cyclopentylamino)-1-oxo-7-sulfanylheptan-2...
Create Date: 2008-01-07
CID: 23634895

2134. thiolate analogue, 36a; CHEMBL235918; BDBM19145
MW:     359.593420 g/mol MF: C17H33N3OS2
IUPAC name: (2S)-2-(tert-butylcarbamothioylamino)-N-cyclopentyl-7-sulfan...
Create Date: 2008-01-07
CID: 23634894

2135. thiolate analogue, 35a; CHEMBL391395; BDBM19144
MW:     343.527820 g/mol MF: C17H33N3O2S
IUPAC name: (2S)-2-(tert-butylcarbamoylamino)-N-cyclopentyl-7-sulfanylhe...
Create Date: 2008-01-07
CID: 23634893

2136. thiolate analogue, 33a; CHEMBL235917; BDBM19143 ...
MW:     328.513180 g/mol MF: C17H32N2O2S
IUPAC name: (2S)-N-cyclopentyl-2-(2,2-dimethylpropanoylamino)-7-sulfanyl...
Create Date: 2008-01-07
CID: 23634892

2137. thiolate analogue, 30a; CHEMBL235704; BDBM19142 ...
MW:     302.432840 g/mol MF: C14H26N2O3S
IUPAC name: (2S)-N-cyclopentyl-2-[(2-hydroxyacetyl)amino]-7-sulfanylhept...
Create Date: 2008-01-07
CID: 23634891

2138. thiolate analogue, 28a; CHEMBL235703; BDBM19141 ...
MW:     382.947880 g/mol MF: C19H27ClN2O2S
IUPAC name: 4-chloro-N-[(2S)-1-(cyclopentylamino)-1-oxo-7-sulfanylheptan...
Create Date: 2008-01-07
CID: 23634890

2139. thiolate analogue, 27a; CHEMBL235702; BDBM19140 ...
MW:     348.502820 g/mol MF: C19H28N2O2S
IUPAC name: N-[(2S)-1-(cyclopentylamino)-1-oxo-7-sulfanylheptan-2-yl]ben...
Create Date: 2008-01-07
CID: 23634889

2140. thiolate analogue, 26a; CHEMBL235911; SCHEMBL16338810 ...
MW:     244.396760 g/mol MF: C12H24N2OS
IUPAC name: (2S)-2-amino-N-cyclopentyl-7-sulfanylheptanamide
Create Date: 2008-01-07
CID: 23634888

2141. thiolate analogue, 20a; CHEMBL393827; SCHEMBL3497483 ...
MW:     410.613720 g/mol MF: C22H38N2O3S
IUPAC name: tert-butyl N-[(2S)-1-(1-adamantylamino)-1-oxo-7-sulfanylhept...
Create Date: 2008-01-07
CID: 23634771

2142. thiolate analogue, 19a; CHEMBL235909; SCHEMBL3496613 ...
MW:     332.501880 g/mol MF: C16H32N2O3S
IUPAC name: tert-butyl N-[(2S)-1-(tert-butylamino)-1-oxo-7-sulfanylhepta...
Create Date: 2008-01-07
CID: 23634770

2143. thiolate analogue, 15a; CHEMBL235263; BDBM19133
MW:     403.538260 g/mol MF: C21H29N3O3S
IUPAC name: tert-butyl N-[(2S)-1-oxo-1-(quinolin-3-ylamino)-7-sulfanylhe...
Create Date: 2008-01-07
CID: 23634769

2144. Glucosamine analog, 10; BDBM85426
MW:     298.291820 g/mol MF: C13H18N2O6
IUPAC name: 3-amino-N-[2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]benza...
Create Date: 2007-12-12
CID: 23598259

2145. Benzonitrile analogue, 5h; SCHEMBL5297574; BDBM86788 ...
MW:     239.269220 g/mol MF: C15H13NO2
IUPAC name: 4-(2-phenoxyethoxy)benzonitrile
Create Date: 2007-12-05
CID: 21844684

2146. BMS-2; 888719-03-7; N-(4-((1H-pyrrolo[2,3-b]pyridin-4-yl)oxy)-3-fluorophenyl)-1-(4-fluorophenyl)-2-oxo-1,2-dihydropyridine-3-carboxamide ...
MW:     458.416346 g/mol MF: C25H16F2N4O3
IUPAC name: 1-(4-fluorophenyl)-N-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4...
Create Date: 2007-12-05
CID: 21081761

2147. Substrate analogue, 22; N-Methyl-3-nitropropionamide; SCHEMBL13314133 ...
MW:     132.117920 g/mol MF: C4H8N2O3
IUPAC name: N-methyl-3-nitropropanamide
Create Date: 2007-12-05
CID: 20577498

2148. CHEMBL67758; benzothiazole analog 11; SCHEMBL6058083 ...
MW:     385.867240 g/mol MF: C19H16ClN3O2S
IUPAC name: N-(2-chloro-6-methylphenyl)-2-(cyclopropanecarbonylamino)-1,...
Create Date: 2007-12-04
CID: 17960401

2149. Dipyridamole Analogue, 8; CHEMBL398221; BDBM23628 ...
MW:     640.733760 g/mol MF: C30H44N10O6
IUPAC name: benzyl 4-[2,6-bis[bis(2-hydroxyethyl)amino]-8-piperazin-1-yl...
Create Date: 2007-11-05
CID: 16757073

2150. Dipyridamole Analogue, 6; BDBM23626; 2-({6-[bis(2-hydroxyethyl)amino]-4,8-bis(4-methylpiperazin-1-yl)pyrimido[5,4-d][1,3]diazin-2-yl}(2-hydroxyethyl)amino)ethan-1-ol
MW:     534.654880 g/mol MF: C24H42N10O4
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis(4-methylpiperazin-1...
Create Date: 2007-11-05
CID: 16756976

2151. Dipyridamole Analogue, 5; CHEMBL242870; BDBM23625 ...
MW:     420.466120 g/mol MF: C18H28N8O4
IUPAC name: 2-[[2-(2-hydroxyethylamino)-4,8-dimorpholin-4-ylpyrimido[5,4...
Create Date: 2007-11-05
CID: 16756975

2152. Dipyridamole Analogue, 3; CHEMBL242869; BDBM23623 ...
MW:     388.467320 g/mol MF: C18H28N8O2
IUPAC name: 2-[[2-(2-hydroxyethylamino)-4,8-dipyrrolidin-1-ylpyrimido[5,...
Create Date: 2007-11-05
CID: 16756974

2153. Dipyridamole Analogue, 7; CHEMBL243577; BDBM23627
MW:     706.833360 g/mol MF: C32H54N10O8
IUPAC name: tert-butyl 4-[2,6-bis[bis(2-hydroxyethyl)amino]-4-[4-[(2-met...
Create Date: 2007-11-05
CID: 16756301

2154. Dipyridamole Analogue, 2; CHEMBL242868; BDBM23622 ...
MW:     476.572440 g/mol MF: C22H36N8O4
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-dipyrrolidin-1-ylpyrimi...
Create Date: 2007-11-05
CID: 16756300

2155. Indazole Analogue, 74; CHEMBL231437; BDBM20380 ...
MW:     479.615920 g/mol MF: C30H33N5O
IUPAC name: 1-[[4-[(1R,5S)-8-azabicyclo[3.2.1]octan-8-yl]-2-benzylphenyl...
Create Date: 2007-10-15
CID: 16749569

2156. Indazole Analogue, 73; CHEMBL437165; BDBM20379 ...
MW:     465.589340 g/mol MF: C29H31N5O
IUPAC name: 1-[[4-[(1R,5S)-8-azabicyclo[3.2.1]octan-8-yl]-2-benzylphenyl...
Create Date: 2007-10-15
CID: 16749568

2157. Indazole Analogue, 72; CHEMBL438656; BDBM20378 ...
MW:     389.493380 g/mol MF: C23H27N5O
IUPAC name: 1-[[4-[(1R,5S)-8-azabicyclo[3.2.1]octan-8-yl]-2-methylphenyl...
Create Date: 2007-10-15
CID: 16749567

2158. Indazole Analogue, 71; CHEMBL231436; BDBM20377 ...
MW:     389.493380 g/mol MF: C23H27N5O
IUPAC name: 1-[[4-[(1R,5S)-8-azabicyclo[3.2.1]octan-8-yl]-3-methylphenyl...
Create Date: 2007-10-15
CID: 16749566

2159. Indazole Analogue, 70; CHEMBL388871; BDBM20376 ...
MW:     369.419160 g/mol MF: C22H19N5O
IUPAC name: 1-(1H-indazol-4-yl)-3-[(9-methylcarbazol-3-yl)methyl]urea
Create Date: 2007-10-15
CID: 16749565

2160. Indazole Analogue, 69; CHEMBL231238; BDBM20375 ...
MW:     349.429520 g/mol MF: C20H23N5O
IUPAC name: 1-[(1-ethyl-2,3-dihydroindol-5-yl)methyl]-3-(1-methylindazol...
Create Date: 2007-10-15
CID: 16749467

2161. Indazole Analogue, 68; CHEMBL388870; BDBM20374 ...
MW:     335.402940 g/mol MF: C19H21N5O
IUPAC name: 1-[(1-ethyl-2,3-dihydroindol-5-yl)methyl]-3-(1H-indazol-4-yl...
Create Date: 2007-10-15
CID: 16749466

2162. Indazole Analogue, 67; CHEMBL442070; BDBM20373 ...
MW:     333.387060 g/mol MF: C19H19N5O
IUPAC name: 1-(1-methylindazol-4-yl)-3-[(1-methylindol-5-yl)methyl]urea
Create Date: 2007-10-15
CID: 16749465

2163. Indazole Analogue, 66; CHEMBL231020; BDBM20372 ...
MW:     425.431246 g/mol MF: C22H21F2N5O2
IUPAC name: 1-[[2,5-difluoro-4-[(1S,5R)-3-oxo-8-azabicyclo[3.2.1]octan-8...
Create Date: 2007-10-15
CID: 16749464

2164. Indazole Analogue, 65; CHEMBL231019; BDBM20371 ...
MW:     469.483806 g/mol MF: C24H25F2N5O3
IUPAC name: 1-[[2,5-difluoro-4-[(1'S,5'R)-spiro[1,3-dioxolane-2,3'-8-aza...
Create Date: 2007-10-15
CID: 16749463

2165. Indazole Analogue, 63; CHEMBL437195; BDBM20369 ...
MW:     411.447726 g/mol MF: C22H23F2N5O
IUPAC name: 1-[[4-[(1R,5S)-8-azabicyclo[3.2.1]octan-8-yl]-2,3-difluoroph...
Create Date: 2007-10-15
CID: 16749462

2166. Indazole Analogue, 61; CHEMBL231227; BDBM20367 ...
MW:     393.457263 g/mol MF: C22H24FN5O
IUPAC name: 1-[[4-[(1R,5S)-8-azabicyclo[3.2.1]octan-8-yl]-3-fluorophenyl...
Create Date: 2007-10-15
CID: 16749355

2167. Indazole Analogue, 59; CHEMBL396960; BDBM20365 ...
MW:     409.911860 g/mol MF: C22H24ClN5O
IUPAC name: 1-[[4-[(1R,5S)-8-azabicyclo[3.2.1]octan-8-yl]-3-chlorophenyl...
Create Date: 2007-10-15
CID: 16749354

2168. Indazole Analogue, 58; CHEMBL231225; BDBM20364 ...
MW:     443.464770 g/mol MF: C23H24F3N5O
IUPAC name: 1-[[4-[(1R,5S)-8-azabicyclo[3.2.1]octan-8-yl]-3-(trifluorome...
Create Date: 2007-10-15
CID: 16749353

2169. Indazole Analogue, 56; CHEMBL396714; BDBM20362 ...
MW:     409.911860 g/mol MF: C22H24ClN5O
IUPAC name: 1-[[4-[(1R,5S)-8-azabicyclo[3.2.1]octan-8-yl]-2-chlorophenyl...
Create Date: 2007-10-15
CID: 16749352

2170. Indazole Analogue, 54; CHEMBL396713; SCHEMBL5016001 ...
MW:     399.437026 g/mol MF: C21H23F2N5O
IUPAC name: 1-[[4-(azepan-1-yl)-3,5-difluorophenyl]methyl]-3-(1H-indazol...
Create Date: 2007-10-15
CID: 16749351

2171. Indazole Analogue, 52; CHEMBL388032; SCHEMBL5016015 ...
MW:     431.454070 g/mol MF: C22H24F3N5O
IUPAC name: 1-[[4-(azepan-1-yl)-3-(trifluoromethyl)phenyl]methyl]-3-(1H-...
Create Date: 2007-10-15
CID: 16749350

2172. Indazole Analogue, 50; CHEMBL230380; SCHEMBL5026114 ...
MW:     397.901160 g/mol MF: C21H24ClN5O
IUPAC name: 1-[[4-(azepan-1-yl)-2-chlorophenyl]methyl]-3-(1H-indazol-4-y...
Create Date: 2007-10-15
CID: 16749244

2173. Indazole Analogue, 64; CHEMBL230919; BDBM20370 ...
MW:     411.447726 g/mol MF: C22H23F2N5O
IUPAC name: 1-[[4-[(1R,5S)-8-azabicyclo[3.2.1]octan-8-yl]-2,5-difluoroph...
Create Date: 2007-10-15
CID: 16748374

2174. Indazole Analogue, 62; CHEMBL395262; BDBM20368 ...
MW:     411.447726 g/mol MF: C22H23F2N5O
IUPAC name: 1-[[4-[(1R,5S)-8-azabicyclo[3.2.1]octan-8-yl]-3,5-difluoroph...
Create Date: 2007-10-15
CID: 16748373

2175. Indazole Analogue, 60; CHEMBL231226; BDBM20366 ...
MW:     454.362860 g/mol MF: C22H24BrN5O
IUPAC name: 1-[[4-[(1R,5S)-8-azabicyclo[3.2.1]octan-8-yl]-3-bromophenyl]...
Create Date: 2007-10-15
CID: 16748252

2176. Indazole Analogue, 57; CHEMBL231520; BDBM20363 ...
MW:     443.464770 g/mol MF: C23H24F3N5O
IUPAC name: 1-[[4-[(1S,5R)-8-azabicyclo[3.2.1]octan-8-yl]-2-(trifluorome...
Create Date: 2007-10-15
CID: 16748251

2177. Indazole Analogue, 55; CHEMBL231519; BDBM20361 ...
MW:     375.466800 g/mol MF: C22H25N5O
IUPAC name: 1-[[4-[(1R,5S)-8-azabicyclo[3.2.1]octan-8-yl]phenyl]methyl]-...
Create Date: 2007-10-15
CID: 16748250

2178. Indazole Analogue, 51; CHEMBL230485; SCHEMBL5018039 ...
MW:     431.454070 g/mol MF: C22H24F3N5O
IUPAC name: 1-[[4-(azepan-1-yl)-2-(trifluoromethyl)phenyl]methyl]-3-(1H-...
Create Date: 2007-10-15
CID: 16748249

2179. Indazole Analogue, 76; CHEMBL231535; BDBM20382 ...
MW:     459.626280 g/mol MF: C28H37N5O
IUPAC name: 1-[[4-[(1R,5S)-8-azabicyclo[3.2.1]octan-8-yl]-2-(3,3-dimethy...
Create Date: 2007-10-15
CID: 16747868

2180. Indazole Analogue, 75; CHEMBL231438; BDBM20381 ...
MW:     417.546540 g/mol MF: C25H31N5O
IUPAC name: 1-[[4-[(1S,5R)-8-azabicyclo[3.2.1]octan-8-yl]-2-propan-2-ylp...
Create Date: 2007-10-15
CID: 16747867

2181. 6-Mercaptopurine analog.; 9-[(1S,4R)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-2,3-dihydro-1H-purine-6-thione; 6H-Purine-6-thione, 1,2,3,9-tetrahydro-9-[(1S,4R)-4-(hydroxymethyl)-2-cyclopenten-1-yl]-
MW:     250.320060 g/mol MF: C11H14N4OS
IUPAC name: 9-[(1S,4R)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-2,3-dihydro...
Create Date: 2007-09-14
CID: 16727519

2182. Arzoxifene analogue, 15; CHEMBL226329; BDBM19448 ...
MW:     460.587820 g/mol MF: C27H28N2O3S
IUPAC name: 2-(4-aminophenyl)-3-[4-(2-piperidin-1-ylethoxy)phenoxy]-1-be...
Create Date: 2007-08-27
CID: 16719866

2183. CHEMBL389907; Arzoxifene analogue, 13; SCHEMBL4510110 ...
MW:     523.663560 g/mol MF: C28H29NO5S2
IUPAC name: 2-(4-methylsulfonylphenyl)-3-[4-(2-piperidin-1-ylethoxy)phen...
Create Date: 2007-08-27
CID: 16719865

2184. Arzoxifene analogue, 18; CHEMBL226379; BDBM19450 ...
MW:     523.086040 g/mol MF: C29H31ClN2O3S
IUPAC name: 2-[4-(2-chloroethylamino)phenyl]-3-[4-(2-piperidin-1-ylethox...
Create Date: 2007-08-27
CID: 16719863

2185. Arzoxifene analogue, 16; CHEMBL449038; BDBM19449 ...
MW:     537.069560 g/mol MF: C29H29ClN2O4S
IUPAC name: 2-chloro-N-[4-[6-hydroxy-3-[4-(2-piperidin-1-ylethoxy)phenox...
Create Date: 2007-08-27
CID: 16719760

2186. (-)-N-Methylphysostigmine; UNII-S6C28CTI07; CHEMBL308043 ...
MW:     289.372720 g/mol MF: C16H23N3O2
IUPAC name: [(3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]in...
Create Date: 2007-07-16
CID: 16219608

2187. SD146 Analog 8; BDBM7087; CHEMBL410740 ...
MW:    1037.168140 g/mol MF: C63H56N8O7
IUPAC name: N-(1H-benzimidazol-2-yl)-3-[[(4R,5S,6S,7R)-3-[[3-(1H-benzimi...
Create Date: 2007-07-03
CID: 16130392

2188. Piperazine analogue, 22; CHEMBL437146; BDBM21409 ...
MW:     731.884040 g/mol MF: C36H41N7O6S2
IUPAC name: 4-[4-[[4-[[(2R)-4-(dimethylamino)-1-phenylsulfanylbutan-2-yl...
Create Date: 2007-06-18
CID: 16109117

2189. Piperazine analogue, 20; CHEMBL385104; BDBM21407 ...
MW:     716.869400 g/mol MF: C36H40N6O6S2
IUPAC name: 4-(4-benzoylpiperazin-1-yl)-N-[4-[[(2R)-4-(dimethylamino)-1-...
Create Date: 2007-06-18
CID: 16109116

2190. Piperazine analogue, 21; CHEMBL439495; BDBM21408 ...
MW:     766.949680 g/mol MF: C36H42N6O7S3
IUPAC name: N-[4-[[(2R)-4-(dimethylamino)-1-phenylsulfanylbutan-2-yl]ami...
Create Date: 2007-06-18
CID: 16109088

2191. Pyrrolocarbazole Analog 9; JMC515680 Compound 4; CHEMBL375085 ...
MW:     324.375240 g/mol MF: C22H16N2O
Create Date: 2007-06-18
CID: 16105511

2192. Pyrrolocarbazole Analog 8; CHEMBL374581; BDBM14174 ...
MW:     324.375240 g/mol MF: C22H16N2O
Create Date: 2007-06-18
CID: 16105503

2193. 2-(benzylamino)-5-isopropyl-5-methylthiazol-4(5H)-one; 2-Benzylamine analog 2; CHEMBL217983 ...
MW:     262.370520 g/mol MF: C14H18N2OS
IUPAC name: 2-(benzylamino)-5-methyl-5-propan-2-yl-1,3-thiazol-4-one
Create Date: 2007-06-18
CID: 16105494

2194. 2-Benzylamine analog 4; CHEMBL220816; SCHEMBL1606574 ...
MW:     276.397100 g/mol MF: C15H20N2OS
IUPAC name: 5-methyl-2-[[(1R)-1-phenylethyl]amino]-5-propan-2-yl-1,3-thi...
Create Date: 2007-06-18
CID: 16105486

2195. 2-Benzylamine analog 3; CHEMBL376470; SCHEMBL1605158 ...
MW:     276.397100 g/mol MF: C15H20N2OS
IUPAC name: 5-methyl-2-[[(1S)-1-phenylethyl]amino]-5-propan-2-yl-1,3-thi...
Create Date: 2007-06-18
CID: 16105485

2196. aminothiazole analogue, 2; SCHEMBL4601670; BDBM25657 ...
MW:     228.673743 g/mol MF: C9H6ClFN2S
IUPAC name: 5-chloro-N-(4-fluorophenyl)-1,3-thiazol-2-amine
Create Date: 2007-06-18
CID: 16095351

2197. aminothiazole analogue, 8; SCHEMBL4601257; BDBM25664 ...
MW:     334.030340 g/mol MF: C9H6Br2N2S
IUPAC name: 5-bromo-N-(4-bromophenyl)-1,3-thiazol-2-amine
Create Date: 2007-05-29
CID: 16068853

2198. aminothiazole analogue, 4; SCHEMBL4602544; BDBM25660 ...
MW:     320.125213 g/mol MF: C9H6FIN2S
IUPAC name: N-(4-fluorophenyl)-5-iodo-1,3-thiazol-2-amine
Create Date: 2007-05-29
CID: 16068846

2199. aminothiazole analogue, 3; SCHEMBL4601162; BDBM25658 ...
MW:     273.124743 g/mol MF: C9H6BrFN2S
IUPAC name: 5-bromo-N-(4-fluorophenyl)-1,3-thiazol-2-amine
Create Date: 2007-05-29
CID: 16068845

2200. aminothiazole analogue, 7; SCHEMBL4601915; BDBM25663 ...
MW:     289.579340 g/mol MF: C9H6BrClN2S
IUPAC name: 5-bromo-N-(4-chlorophenyl)-1,3-thiazol-2-amine
Create Date: 2007-05-29
CID: 16068632

2201. AG7088 analogue 4d; BDBM11258; ethyl (2E,4S)-4-[(2S)-2-[(2S)-2-{[(benzyloxy)carbonyl]amino}-3-methylbutanamido]-3-phenylpropanamido]-5-phenylpent-2-enoate ...
MW:     599.716540 g/mol MF: C35H41N3O6
IUPAC name: ethyl (E,4S)-4-[[(2S)-2-[[(2S)-3-methyl-2-(phenylmethoxycarb...
Create Date: 2007-03-08
CID: 15959301

2202. AG7088 analogue 4c; BDBM11257; ethyl (2E,4S)-4-[(2S)-2-[(2S)-3-methyl-2-[(5-methyl-1,2-oxazol-3-yl)formamido]butanamido]-3-phenylpropanamido]-5-phenylpent-2-enoate ...
MW:     574.667320 g/mol MF: C32H38N4O6
IUPAC name: ethyl (E,4S)-4-[[(2S)-2-[[(2S)-3-methyl-2-[(5-methyl-1,2-oxa...
Create Date: 2007-03-08
CID: 15959300

2203. AG7088 analogue 4b; BDBM11256; ethyl (2E,4S)-4-[(2S)-2-[(2S)-2-{[(benzyloxy)carbonyl]amino}-3-methylbutanamido]-3-(4-fluorophenyl)propanamido]-5-phenylpent-2-enoate ...
MW:     617.707003 g/mol MF: C35H40FN3O6
IUPAC name: ethyl (E,4S)-4-[[(2S)-3-(4-fluorophenyl)-2-[[(2S)-3-methyl-2...
Create Date: 2007-03-08
CID: 15959299

2204. AG7088 analogue 4a; BDBM11255; ethyl (2E,4S)-4-[(2S)-3-(4-fluorophenyl)-2-[(2S)-3-methyl-2-[(5-methyl-1,2-oxazol-3-yl)formamido]butanamido]propanamido]-5-phenylpent-2-enoate ...
MW:     592.657783 g/mol MF: C32H37FN4O6
IUPAC name: ethyl (E,4S)-4-[[(2S)-3-(4-fluorophenyl)-2-[[(2S)-3-methyl-2...
Create Date: 2007-03-08
CID: 15959298

2205. AG7088 analogue 3d; BDBM11254; ethyl (2E,4S)-4-[(2R,5S)-2-benzyl-5-{[(benzyloxy)carbonyl]amino}-6-methyl-4-oxoheptanamido]-5-phenylpent-2-enoate ...
MW:     598.728480 g/mol MF: C36H42N2O6
IUPAC name: ethyl (E,4S)-4-[[(2R,5S)-2-benzyl-6-methyl-4-oxo-5-(phenylme...
Create Date: 2007-03-08
CID: 15959297

2206. AG7088 analogue 3c; BDBM11253; ethyl (2E,4S)-4-[(2R,5S)-2-benzyl-6-methyl-5-[(5-methyl-1,2-oxazol-3-yl)formamido]-4-oxoheptanamido]-5-phenylpent-2-enoate ...
MW:     573.679260 g/mol MF: C33H39N3O6
IUPAC name: ethyl (E,4S)-4-[[(2R,5S)-2-benzyl-6-methyl-5-[(5-methyl-1,2-...
Create Date: 2007-03-08
CID: 15959296

2207. AG7088 analogue 3b; BDBM11252; ethyl (2E,4S)-4-[(2R,5S)-5-{[(benzyloxy)carbonyl]amino}-2-[(4-fluorophenyl)methyl]-6-methyl-4-oxoheptanamido]-5-phenylpent-2-enoate ...
MW:     616.718943 g/mol MF: C36H41FN2O6
IUPAC name: ethyl (E,4S)-4-[[(2R,5S)-2-[(4-fluorophenyl)methyl]-6-methyl...
Create Date: 2007-03-08
CID: 15959295

2208. AG7088 analogue 3a; BDBM11251; ethyl (2E,4S)-4-[(2R,5S)-2-[(4-fluorophenyl)methyl]-6-methyl-5-[(5-methyl-1,2-oxazol-3-yl)formamido]-4-oxoheptanamido]-5-phenylpent-2-enoate ...
MW:     591.669723 g/mol MF: C33H38FN3O6
IUPAC name: ethyl (E,4S)-4-[[(2R,5S)-2-[(4-fluorophenyl)methyl]-6-methyl...
Create Date: 2007-03-08
CID: 15959294

2209. AG7088 analogue 2b; BDBM11248; ethyl (2E,4S)-4-[(2S)-2-[(2S)-2-{[(benzyloxy)carbonyl]amino}-3-methylbutanamido]-3-(4-fluorophenyl)propanamido]-5-[(3S)-2-oxopyrrolidin-3-yl]pent-2-enoate ...
MW:     624.699643 g/mol MF: C33H41FN4O7
IUPAC name: ethyl (E,4S)-4-[[(2S)-3-(4-fluorophenyl)-2-[[(2S)-3-methyl-2...
Create Date: 2007-03-08
CID: 15959293

2210. AG7088 analogue 1d; BDBM11246; ethyl (2E,4S)-4-[(2R,5S)-2-benzyl-5-{[(benzyloxy)carbonyl]amino}-6-methyl-4-oxoheptanamido]-5-[(3S)-2-oxopyrrolidin-3-yl]pent-2-enoate ...
MW:     605.721120 g/mol MF: C34H43N3O7
IUPAC name: ethyl (E,4S)-4-[[(2R,5S)-2-benzyl-6-methyl-4-oxo-5-(phenylme...
Create Date: 2007-03-08
CID: 15959292

2211. AG7088 analogue 1b; BDBM11244; ethyl (2E,4S)-4-[(2R,5S)-5-{[(benzyloxy)carbonyl]amino}-2-[(4-fluorophenyl)methyl]-6-methyl-4-oxoheptanamido]-5-[(3S)-2-oxopyrrolidin-3-yl]pent-2-enoate ...
MW:     623.711583 g/mol MF: C34H42FN3O7
IUPAC name: ethyl (E,4S)-4-[[(2R,5S)-2-[(4-fluorophenyl)methyl]-6-methyl...
Create Date: 2007-03-08
CID: 15959291

2212. AG7088 analogue 2c; CHEMBL238216; BDBM11249 ...
MW:     581.659960 g/mol MF: C30H39N5O7
IUPAC name: ethyl (E,4S)-4-[[(2S)-2-[[(2S)-3-methyl-2-[(5-methyl-1,2-oxa...
Create Date: 2007-03-08
CID: 15956553

2213. P3 arylpyrrole analog 9; BDBM9128; CHEMBL131941 ...
MW:     788.778399 g/mol MF: C39H42F6N6O5
IUPAC name: (2S)-1-[(2S,4R)-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4-dihydro-...
Create Date: 2007-03-08
CID: 15954466

2214. P3 arylpyrrole analog 8; BDBM9127; CHEMBL337701 ...
MW:     755.225490 g/mol MF: C38H42ClF3N6O5
IUPAC name: (2S)-4-[[1-(2-chlorophenyl)pyrrol-3-yl]methyl]-1-[(2S,4R)-2-...
Create Date: 2007-03-08
CID: 15954465

2215. P3 arylpyrrole analog 7; BDBM9126; CHEMBL337449 ...
MW:     734.807010 g/mol MF: C39H45F3N6O5
IUPAC name: (2S)-1-[(2S,4R)-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4-dihydro-...
Create Date: 2007-03-08
CID: 15954464

2216. P3 arylpyrrole analog 6; BDBM9125; CHEMBL131994 ...
MW:     738.770893 g/mol MF: C38H42F4N6O5
IUPAC name: (2S)-4-[[1-(2-fluorophenyl)pyrrol-3-yl]methyl]-1-[(2S,4R)-2-...
Create Date: 2007-03-08
CID: 15954463

2217. P3 arylpyrrole analog 5; BDBM9124; CHEMBL406460 ...
MW:     745.789890 g/mol MF: C39H42F3N7O5
IUPAC name: (2S)-4-[[1-(2-cyanophenyl)pyrrol-3-yl]methyl]-1-[(2S,4R)-2-h...
Create Date: 2007-03-08
CID: 15954462

2218. P3 arylpyrrole analog 4; BDBM9123; CHEMBL437449 ...
MW:     788.778399 g/mol MF: C39H42F6N6O5
IUPAC name: (2S)-1-[(2S,4R)-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4-dihydro-...
Create Date: 2007-03-08
CID: 15954461

2219. imidazolidin-2-one analog; BDBM9230; CHEMBL262204 ...
MW:     603.749840 g/mol MF: C38H41N3O4
IUPAC name: (2R,4S)-2-benzyl-5-[(5S)-3,5-dibenzyl-2-oxoimidazolidin-1-yl...
Create Date: 2007-03-08
CID: 15954110

2220. 5-azaindole analog 10; CHEMBL210199; BDBM14872 ...
MW:     470.470106 g/mol MF: C27H20F2N4O2
IUPAC name: 1-(2,6-difluorophenyl)-3-[[3-[2-hydroxy-3-(1H-pyrrolo[3,2-c]...
Create Date: 2007-02-12
CID: 15604798

2221. CHEMBL419530; Acylphosphonamide analogue; BDBM50069872
MW:     561.734282 g/mol MF: C35H48NO3P
IUPAC name: N-[[2,6-di(propan-2-yl)phenoxy]-phenylphosphoryl]-2-[2,4,6-t...
Create Date: 2007-02-09
CID: 15432341

2222. Arzoxifene analogue, 12; CHEMBL226327; SCHEMBL6552026 ...
MW:     445.573180 g/mol MF: C27H27NO3S
IUPAC name: 2-phenyl-3-[4-(2-piperidin-1-ylethoxy)phenoxy]-1-benzothioph...
Create Date: 2007-02-09
CID: 15429026

2223. 5,6,8-Trimethoxy-1,4-dimethylquinolin-2(1H)-one; casimiroin analogue, 1p; CHEMBL449065 ...
MW:     263.289080 g/mol MF: C14H17NO4
IUPAC name: 5,6,8-trimethoxy-1,4-dimethylquinolin-2-one
Create Date: 2007-02-09
CID: 15306617

2224. 5,6,8-Trimethoxy-4-methylquinolin-2(1H)-one; casimiroin analogue, 1o; CHEMBL493181 ...
MW:     249.262500 g/mol MF: C13H15NO4
IUPAC name: 5,6,8-trimethoxy-4-methyl-1H-quinolin-2-one
Create Date: 2007-02-09
CID: 15306616

2225. Conessine analogue, 10; CHEMBL519889; BDBM27215 ...
MW:     356.544740 g/mol MF: C23H36N2O
Create Date: 2007-02-09
CID: 13995914

2226. UNII-Z6K8U43RQF; N-(3-((4-Amino-6,7-dimethoxyquinazolin-2-yl)methylamino)propyl)furan-2-carboxamide; 98902-36-4 ...
MW:     385.417020 g/mol MF: C19H23N5O4
IUPAC name: N-[3-[(4-amino-6,7-dimethoxyquinazolin-2-yl)-methylamino]pro...
Create Date: 2007-02-08
CID: 13544734

2227. 6-methylphysostigmine; Physostigmine analog 31; CHEMBL134251 ...
MW:     289.372720 g/mol MF: C16H23N3O2
IUPAC name: [(3aR,8bS)-3,4,6,8b-tetramethyl-2,3a-dihydro-1H-pyrrolo[2,3-...
Create Date: 2007-02-08
CID: 13006047

2228. 5-Bromo-N-phenylthiazol-2-amine; 63615-95-2; 5-bromo-N-phenyl-1,3-thiazol-2-amine ...
MW:     255.134280 g/mol MF: C9H7BrN2S
IUPAC name: 5-bromo-N-phenyl-1,3-thiazol-2-amine
Create Date: 2007-02-07
CID: 12348630

2229. 57370-13-5; Dipyridamole Analogue, 1; CHEMBL242656 ...
MW:     416.520480 g/mol MF: C20H32N8O2
IUPAC name: 2-[[2-(2-hydroxyethylamino)-4,8-di(piperidin-1-yl)pyrimido[5...
Create Date: 2007-02-07
CID: 12298620

2230. AMPHETAMINE ANALOG; NSC22969; NSC-22969
MW:     233.284700 g/mol MF: C9H15NO4S
IUPAC name: 2-phenylpropan-1-amine;sulfuric acid
Create Date: 2007-02-07
CID: 12213961

2231. FK228 Analogue, 8b; CHEMBL235082; SCHEMBL2196332 ...
MW:     514.658560 g/mol MF: C22H34N4O6S2
IUPAC name: (1S,7R,10S,16E,21R)-7,21-di(propan-2-yl)-2-oxa-12,13-dithia-...
Create Date: 2007-02-05
CID: 12001305

2232. Mannostatin analogue, 4b; Meso-aminocyclopentitetrol, 2a; SCHEMBL15926078 ...
MW:     149.145140 g/mol MF: C5H11NO4
IUPAC name: (1S,2S,3R,4R)-5-aminocyclopentane-1,2,3,4-tetrol
Create Date: 2007-01-11
CID: 11987837

2233. AZD0530 analogue 8; CHEMBL217493; BDBM12230 ...
MW:     527.054900 g/mol MF: C28H35ClN4O4
IUPAC name: N-(2-chloro-5-methoxyphenyl)-5-cyclohexyloxy-7-(3-morpholin-...
Create Date: 2007-01-03
CID: 11974016

2234. 4-quinazolinamine,n-(2-chloro-5-methoxyphenyl)-7-methoxy-5-[3-(4-morpholinyl)propoxy]-; AZD0530 analogue 4; CHEMBL275513 ...
MW:     458.937880 g/mol MF: C23H27ClN4O4
IUPAC name: N-(2-chloro-5-methoxyphenyl)-7-methoxy-5-(3-morpholin-4-ylpr...
Create Date: 2007-01-03
CID: 11973907

2235. AZD0530 analogue 3; CHEMBL384031; SCHEMBL3275761 ...
MW:     412.869440 g/mol MF: C21H21ClN4O3
IUPAC name: N-(5-chloro-1,3-benzodioxol-4-yl)-5-(1-methylpiperidin-4-yl)...
Create Date: 2007-01-03
CID: 11973906

2236. AZD0530 analogue 2; CHEMBL385533; BDBM12224 ...
MW:     385.844100 g/mol MF: C20H20ClN3O3
IUPAC name: N-(2-chloro-5-methoxyphenyl)-5-(oxan-4-yloxy)quinazolin-4-am...
Create Date: 2007-01-03
CID: 11973905

2237. AZD0530 analogue 1; CHEMBL386584; BDBM12223 ...
MW:     398.885920 g/mol MF: C21H23ClN4O2
IUPAC name: N-(2-chloro-5-methoxyphenyl)-5-(1-methylpiperidin-4-yl)oxyqu...
Create Date: 2007-01-03
CID: 11973903

2238. FK228 Analogue, 8a; CHEMBL393360; SCHEMBL2196775 ...
MW:     486.605400 g/mol MF: C20H30N4O6S2
IUPAC name: (1S,7R,10S,16E,21R)-21-methyl-7-propan-2-yl-2-oxa-12,13-dith...
Create Date: 2006-12-18
CID: 11963978

2239. Pyrimidine analogue, 31; CHEMBL272669; SCHEMBL1489529 ...
MW:     398.481980 g/mol MF: C19H22N6O2S
IUPAC name: N-[2-(5-methylfuran-2-yl)-6-(1,3-thiazol-2-yl)pyrimidin-4-yl...
Create Date: 2006-11-29
CID: 11956198

2240. CHEMBL379049; thiolate analogue, 18a; SCHEMBL3495990 ...
MW:     372.565740 g/mol MF: C19H36N2O3S
IUPAC name: tert-butyl N-[(2S)-1-(cycloheptylamino)-1-oxo-7-sulfanylhept...
Create Date: 2006-11-06
CID: 11844893

2241. CHEMBL209551; thiolate analogue, 17a; SCHEMBL3495270 ...
MW:     358.539160 g/mol MF: C18H34N2O3S
IUPAC name: tert-butyl N-[(2S)-1-(cyclohexylamino)-1-oxo-7-sulfanylhepta...
Create Date: 2006-11-06
CID: 11844892

2242. CHEMBL213934; thiolate analogue, 16a; SCHEMBL3497801 ...
MW:     344.512580 g/mol MF: C17H32N2O3S
IUPAC name: tert-butyl N-[(2S)-1-(cyclopentylamino)-1-oxo-7-sulfanylhept...
Create Date: 2006-11-06
CID: 11844891

2243. CHEMBL148471; Pyrrolocarbazole Analog 5; SCHEMBL3082217 ...
MW:     310.348660 g/mol MF: C21H14N2O
Create Date: 2006-10-27
CID: 11809063

2244. Conessine analogue, 13a; CHEMBL454109; SCHEMBL14184392 ...
MW:     455.718860 g/mol MF: C29H49N3O
Create Date: 2006-10-26
CID: 11775426

2245. Isoconessimine; Kurchine; Conessine analogue, 11 ...
MW:     342.561220 g/mol MF: C23H38N2
Create Date: 2006-10-26
CID: 11772257

2246. 4-(4-fluoro-3-(piperazine-1-carbonyl)benzyl)phthalazin-1(2H)-one; 763111-47-3; 4-[[4-fluoro-3-(piperazine-1-carbonyl)phenyl]methyl]-2H-phthalazin-1-one ...
MW:     366.388863 g/mol MF: C20H19FN4O2
IUPAC name: 4-[[4-fluoro-3-(piperazine-1-carbonyl)phenyl]methyl]-2H-phth...
Create Date: 2006-10-26
CID: 11726399

2247. CHEMBL194398; AG7088 analogue 1c; BDBM11245 ...
MW:     580.671900 g/mol MF: C31H40N4O7
IUPAC name: ethyl (E,4S)-4-[[(2R,5S)-2-benzyl-6-methyl-5-[(5-methyl-1,2-...
Create Date: 2006-10-26
CID: 11642725

2248. CHEMBL427643; (1r,2r,3r,4s,5r)-4-Amino-5-Methoxycyclopentane-1,2,3-Triol; Mannostatin analogue, 5 ...
MW:     163.171720 g/mol MF: C6H13NO4
IUPAC name: (1R,2R,3R,4S,5R)-4-amino-5-methoxycyclopentane-1,2,3-triol
Create Date: 2006-10-26
CID: 11636858

2249. CHEMBL268037; (1s,2s,3r,4r)-4-Aminocyclopentane-1,2,3-Triol; Mannostatin analogue, 3 ...
MW:     133.145740 g/mol MF: C5H11NO3
IUPAC name: (1S,2S,3R,4R)-4-aminocyclopentane-1,2,3-triol
Create Date: 2006-10-26
CID: 11593442

2250. CHEMBL295615; spiro[(2-hydroxy)indane-1,40-piperidine] analogue; BDBM50090485 ...
MW:     655.607900 g/mol MF: C35H40Cl2N2O6
IUPAC name: [(2R)-2-(3,4-dichlorophenyl)-2-[2-[(2S)-2-hydroxyspiro[1,2-d...
Create Date: 2006-10-26
CID: 11498370

2251. Saxagliptin Analogue 10g; CHEMBL3350925; BDBM11536 ...
MW:     277.362020 g/mol MF: C15H23N3O2
IUPAC name: (1S,3S,5S)-2-[(2S)-2-amino-2-(4-ethyloxan-4-yl)acetyl]-2-aza...
Create Date: 2006-10-26
CID: 11486126

2252. Saxagliptin Analogue 10b; CHEMBL3350921; BDBM11534 ...
MW:     263.378500 g/mol MF: C15H25N3O
IUPAC name: (1S,3S,5S)-2-[(2S)-2-amino-3,3-diethylpentanoyl]-2-azabicycl...
Create Date: 2006-10-26
CID: 11474372

2253. Saxagliptin Analogue 16d; CHEMBL3350933; SCHEMBL17750701 ...
MW:     263.335440 g/mol MF: C14H21N3O2
IUPAC name: (1S,3S,5S)-2-[(2S)-2-amino-2-[1-(hydroxymethyl)cyclopentyl]a...
Create Date: 2006-10-26
CID: 11451712

2254. Pteridine analogue, 21; BDBM18236; 6-{2-[(2,4-diaminopteridin-6-yl)methyl]-2-azatricyclo[9.4.0.0;{3,8}]pentadeca-1(11),3,5,7,9,12,14-heptaen-6-yl}hex-5-ynoic acid
MW:     477.517220 g/mol MF: C27H23N7O2
IUPAC name: 6-[11-[(2,4-diaminopteridin-6-yl)methyl]benzo[b][1]benzazepi...
Create Date: 2006-10-26
CID: 11431512

2255. Begacestat analogue, 10; CHEMBL458753; SCHEMBL2886692 ...
MW:     419.791299 g/mol MF: C11H12ClF6NO3S2
IUPAC name: 5-chloro-N-[(2S)-5,5,5-trifluoro-1-hydroxy-3-(2,2,2-trifluor...
Create Date: 2006-10-26
CID: 11430071

2256. benzimidazolone analog 2g; CHEMBL372208; BDBM14423 ...
MW:     479.529800 g/mol MF: C28H25N5O3
IUPAC name: 4-[[3-(3-ethoxyphenyl)-1-methyl-2-oxobenzimidazol-5-yl]-hydr...
Create Date: 2006-10-26
CID: 11420216

2257. Saxagliptin Analogue 10d; CHEMBL3350924; BDBM11535 ...
MW:     261.362620 g/mol MF: C15H23N3O
IUPAC name: (1S,3S,5S)-2-[(2S)-2-amino-2-(1-ethylcyclopentyl)acetyl]-2-a...
Create Date: 2006-10-26
CID: 11406220

2258. Saxagliptin Analogue 10a; CHEMBL3350920; BDBM11533 ...
MW:     235.325340 g/mol MF: C13H21N3O
IUPAC name: (1S,3S,5S)-2-[(2S)-2-amino-3,3-dimethylpentanoyl]-2-azabicyc...
Create Date: 2006-10-26
CID: 11405365

2259. Pteridine analogue, 19; BDBM18234; 4-{2-[(2,4-diaminopteridin-6-yl)methyl]-2-azatricyclo[9.4.0.0;{3,8}]pentadeca-1(11),3,5,7,9,12,14-heptaen-6-yl}but-3-ynoic acid
MW:     449.464060 g/mol MF: C25H19N7O2
IUPAC name: 4-[11-[(2,4-diaminopteridin-6-yl)methyl]benzo[b][1]benzazepi...
Create Date: 2006-10-26
CID: 11396736

2260. Indazole Analogue, 53; CHEMBL231422; SCHEMBL4029233 ...
MW:     381.446563 g/mol MF: C21H24FN5O
IUPAC name: 1-[[4-(azepan-1-yl)-3-fluorophenyl]methyl]-3-(1H-indazol-4-y...
Create Date: 2006-10-26
CID: 11338019

2261. Saxagliptin Analogue 16c; CHEMBL3350931; SCHEMBL14899601 ...
MW:     249.308860 g/mol MF: C13H19N3O2
IUPAC name: (1S,3S,5S)-2-[(2S)-2-amino-2-[1-(hydroxymethyl)cyclobutyl]ac...
Create Date: 2006-10-26
CID: 11302974

2262. benzimidazolone analog 2c; CHEMBL382288; BDBM14419 ...
MW:     469.922300 g/mol MF: C26H20ClN5O2
IUPAC name: 4-[[3-(3-chlorophenyl)-1-methyl-2-oxobenzimidazol-5-yl]-hydr...
Create Date: 2006-10-26
CID: 11236748

2263. Saxagliptin Analogue 23; CHEMBL3350935; SCHEMBL13007362 ...
MW:     299.410600 g/mol MF: C18H25N3O
IUPAC name: (1S,3S,5S)-2-[(2S)-2-(1-adamantyl)-2-aminoacetyl]-2-azabicyc...
Create Date: 2006-10-26
CID: 11223701

2264. Saxagliptin Analogue 18d; CHEMBL3350929; SCHEMBL14899071 ...
MW:     293.361420 g/mol MF: C15H23N3O3
IUPAC name: (1S,3S,5S)-2-[(2S)-2-amino-2-[1-(1,2-dihydroxyethyl)cyclopen...
Create Date: 2006-10-26
CID: 11220098

2265. Saxagliptin Analogue 16e; CHEMBL3350926; BDBM11539 ...
MW:     277.362020 g/mol MF: C15H23N3O2
IUPAC name: (1S,3S,5S)-2-[(2S)-2-amino-2-[1-(hydroxymethyl)cyclohexyl]ac...
Create Date: 2006-10-26
CID: 11200151

2266. Pteridine analogue, 20; BDBM18235; 5-{2-[(2,4-diaminopteridin-6-yl)methyl]-2-azatricyclo[9.4.0.0;{3,8}]pentadeca-1(11),3,5,7,9,12,14-heptaen-6-yl}pent-4-ynoic acid
MW:     463.490640 g/mol MF: C26H21N7O2
IUPAC name: 5-[11-[(2,4-diaminopteridin-6-yl)methyl]benzo[b][1]benzazepi...
Create Date: 2006-10-26
CID: 11190448

2267. 3-phenylquinoxaline-5-carboxamide; quinoxaline analogue, 3a; SCHEMBL7111338 ...
MW:     249.267340 g/mol MF: C15H11N3O
IUPAC name: 3-phenylquinoxaline-5-carboxamide
Create Date: 2006-10-26
CID: 11184249

2268. CHEMBL436301; 2-Furancarboxylic acid, 5-ethyl-4,5-dihydro-4-oxo-5-phenyl-; 853260-98-7 ...
MW:     232.231980 g/mol MF: C13H12O4
IUPAC name: 5-ethyl-4-oxo-5-phenylfuran-2-carboxylic acid
Create Date: 2006-10-26
CID: 11148966

2269. carbocyclic analogue, 8; CHEMBL349823; BDBM19801 ...
MW:     360.447320 g/mol MF: C20H28N2O4
IUPAC name: benzyl N-[(2S)-4-methyl-1-oxo-1-[(2-oxocyclohexyl)amino]pent...
Create Date: 2006-10-26
CID: 10832380

2270. carbocyclic analogue, 7; CHEMBL162389; BDBM19800 ...
MW:     346.420740 g/mol MF: C19H26N2O4
IUPAC name: benzyl N-[(2S)-4-methyl-1-oxo-1-[(2-oxocyclopentyl)amino]pen...
Create Date: 2006-10-25
CID: 10569603

2271. pyridylthiophene analog 9; BDBM9091; CHEMBL373039 ...
MW:     841.337870 g/mol MF: C41H44ClF3N6O6S
IUPAC name: (2S)-4-[2-[5-(4-chlorophenyl)-1,3-oxazol-2-yl]propan-2-yl]-1...
Create Date: 2006-10-25
CID: 10284289

2272. CHEMBL200217; AZD0530 analogue 7; SCHEMBL3200998 ...
MW:     529.027720 g/mol MF: C27H33ClN4O5
IUPAC name: N-(2-chloro-5-methoxyphenyl)-7-(3-morpholin-4-ylpropoxy)-5-(...
Create Date: 2006-10-25
CID: 10279981

2273. Homoprenyl analogue, 23; CHEMBL379892; SCHEMBL1964875 ...
MW:     481.353770 g/mol MF: C18H20IN5OS
IUPAC name: 8-(2-iodo-5-methoxyphenyl)sulfanyl-9-(4-methylpent-3-enyl)pu...
Create Date: 2006-10-25
CID: 10277546

2274. P3 benzofuran analog 8; BDBM9158; CHEMBL325829 ...
MW:     695.727910 g/mol MF: C36H40F3N5O6
IUPAC name: (2S)-4-(1-benzofuran-2-ylmethyl)-1-[(2S,4R)-2-hydroxy-5-[[(3...
Create Date: 2006-10-25
CID: 10233724

2275. P3 benzofuran analog 7; BDBM9157; CHEMBL324461 ...
MW:     695.727910 g/mol MF: C36H40F3N5O6
IUPAC name: (2S)-4-(1-benzofuran-2-ylmethyl)-1-[(2S,4R)-2-hydroxy-5-[[(3...
Create Date: 2006-10-25
CID: 10233723

2276. AZD0530 analogue 9; CHEMBL216703; SCHEMBL3196301 ...
MW:     515.001140 g/mol MF: C26H31ClN4O5
IUPAC name: N-(2-chloro-5-methoxyphenyl)-7-(3-morpholin-4-ylpropoxy)-5-(...
Create Date: 2006-10-25
CID: 10229538

2277. P3 benzofuran analog 9; BDBM9159; CHEMBL321814 ...
MW:     730.172970 g/mol MF: C36H39ClF3N5O6
IUPAC name: (2S)-4-[(7-chloro-1-benzofuran-2-yl)methyl]-1-[(2S,4R)-2-hyd...
Create Date: 2006-10-25
CID: 10190506

2278. P3 arylpyrrole analog 3; BDBM9122; CHEMBL341089 ...
MW:     720.780430 g/mol MF: C38H43F3N6O5
IUPAC name: (2S)-1-[(2S,4R)-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4-dihydro-...
Create Date: 2006-10-25
CID: 10190433

2279. AZD0530 analogue 6; CHEMBL214665; SCHEMBL3203386 ...
MW:     442.895420 g/mol MF: C22H23ClN4O4
IUPAC name: N-(5-chloro-1,3-benzodioxol-4-yl)-7-methoxy-5-(1-methylpiper...
Create Date: 2006-10-25
CID: 10181898

2280. benzyl amide analog., 8; CHEMBL271272; SCHEMBL4854991 ...
MW:     476.547460 g/mol MF: C25H24N4O4S
IUPAC name: N-[[4-(methanesulfonamido)phenyl]methyl]-4-[2-methyl-5-(5-me...
Create Date: 2006-10-25
CID: 10162609

2281. phenyl amide analog., 4; CHEMBL411661; SCHEMBL4856439 ...
MW:     399.441840 g/mol MF: C24H21N3O3
IUPAC name: N-(4-methoxyphenyl)-4-[2-methyl-5-(5-methyl-1,3,4-oxadiazol-...
Create Date: 2006-10-25
CID: 10135552

2282. AZD0530 analogue 5; CHEMBL385240; SCHEMBL3198124 ...
MW:     428.911900 g/mol MF: C22H25ClN4O3
IUPAC name: N-(2-chloro-5-methoxyphenyl)-7-methoxy-5-(1-methylpiperidin-...
Create Date: 2006-10-25
CID: 10113430

2283. CHEMBL519443; 3-(4-methoxyphenyl)quinoxaline-5-carboxamide; quinoxaline analogue, 3e ...
MW:     279.293320 g/mol MF: C16H13N3O2
IUPAC name: 3-(4-methoxyphenyl)quinoxaline-5-carboxamide
Create Date: 2006-10-25
CID: 9965481

2284. CHEMBL312933; benzothiazole analog 13a; BDBM13357 ...
MW:     453.944500 g/mol MF: C22H20ClN5O2S
IUPAC name: N-(2-chloro-6-methylphenyl)-2-[[6-(2-hydroxyethylamino)pyrid...
Create Date: 2006-10-25
CID: 9933645

2285. CHEMBL521428; quinoxaline analogue, 3d; SCHEMBL7107333 ...
MW:     317.265310 g/mol MF: C16H10F3N3O
IUPAC name: 3-[4-(trifluoromethyl)phenyl]quinoxaline-5-carboxamide
Create Date: 2006-10-25
CID: 9922953

2286. CHEMBL33661; Diphenylimidazole analogue; SCHEMBL3378259 ...
MW:     432.581020 g/mol MF: C25H28N4OS
IUPAC name: 1-[5-[(4,5-diphenyl-1H-imidazol-2-yl)sulfinyl]pentyl]-3,5-di...
Create Date: 2006-10-25
CID: 9824139

2287. CHEMBL357490; Pyrrolocarbazole Analog 6; SCHEMBL3072275 ...
MW:     310.348660 g/mol MF: C21H14N2O
Create Date: 2006-10-25
CID: 9796713

2288. Aromatic hydrazone analog; SCHEMBL8357904; 3-Furancarbothioamide, N-[[4-chloro-3-(4-morpholinylimino)methyl]phenyl]-2-methyl ...
MW:     363.861720 g/mol MF: C17H18ClN3O2S
IUPAC name: N-[4-chloro-3-[(E)-morpholin-4-yliminomethyl]phenyl]-2-methy...
Create Date: 2006-10-24
CID: 9574982

2289. CHEMBL196526; CHEBI:47379; N-ACETYL-L-PHENYLALANYL-4-[DIFLUORO(PHOSPHONO)METHYL]-L-PHENYLALANINAMIDE ...
MW:     483.402328 g/mol MF: C21H24F2N3O6P
IUPAC name: [[4-[(2S)-2-[[(2S)-2-acetamido-3-phenylpropanoyl]amino]-3-am...
Create Date: 2006-09-12
CID: 9547919

2290. hydroxamate analogue 43; BDBM8506; CHEMBL437504 ...
MW:     318.364363 g/mol MF: C13H19FN2O4S
IUPAC name: (2R,3R)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-hydroxy...
Create Date: 2006-05-10
CID: 6539690

2291. N-[6-(3-methoxyphenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]cyclopropanecarboxamide; AC1O6ZUC; 6-aryl-pyrazolo[3,4-b]pyridine analogue 9 ...
MW:     308.334540 g/mol MF: C17H16N4O2
IUPAC name: N-[6-(3-methoxyphenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]cyclop...
Create Date: 2006-05-10
CID: 6539570

2292. 6-aryl-pyrazolo[3,4-b]pyridine analogue 7; AC1O6ZU8; BDBM8343 ...
MW:     310.307360 g/mol MF: C16H14N4O3
IUPAC name: N-[(6Z)-6-(3-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)-1,2-...
Create Date: 2006-05-10
CID: 6539568

2293. SB-711237; N-[6-(4-methoxyphenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]cyclopropanecarboxamide; 6-aryl-pyrazolo[3,4-b]pyridine analogue 6 ...
MW:     308.334540 g/mol MF: C17H16N4O2
IUPAC name: N-[6-(4-methoxyphenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]cyclop...
Create Date: 2006-05-10
CID: 6539567

2294. N-(6-phenyl-1H-pyrazolo[3,4-b]pyridin-3-yl)cyclopropanecarboxamide; N-{6-phenyl-1H-pyrazolo[3,4-b]pyridin-3-yl}cyclopropanecarboxamide; 6-aryl-pyrazolo[3,4-b]pyridine analogue 4 ...
MW:     278.308560 g/mol MF: C16H14N4O
IUPAC name: N-(6-phenyl-1H-pyrazolo[3,4-b]pyridin-3-yl)cyclopropanecarbo...
Create Date: 2006-05-10
CID: 6539565

2295. 6-[(2-iodo-5-methoxyphenyl)methyl]-5-methylpyrido[2,3-d]pyrimidine-2,4-diamine; AC1O5AQU; Piritrexim analogue, 56 ...
MW:     421.235610 g/mol MF: C16H16IN5O
IUPAC name: 6-[(2-iodo-5-methoxyphenyl)methyl]-5-methylpyrido[2,3-d]pyri...
Create Date: 2006-04-29
CID: 6481092

2296. 6-[(5-iodo-2-methoxyphenyl)methyl]-5-methylpyrido[2,3-d]pyrimidine-2,4-diamine; AC1O5AQR; Piritrexim analogue, 55 ...
MW:     421.235610 g/mol MF: C16H16IN5O
IUPAC name: 6-[(5-iodo-2-methoxyphenyl)methyl]-5-methylpyrido[2,3-d]pyri...
Create Date: 2006-04-29
CID: 6481091

2297. ethyl 4-[2-({2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl}methyl)-4-methoxyphenoxy]butanoate; ethyl 4-[2-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methyl]-4-methoxyphenoxy]butanoate; AC1O5AQO ...
MW:     425.480880 g/mol MF: C22H27N5O4
IUPAC name: ethyl 4-[2-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl...
Create Date: 2006-04-29
CID: 6481090

2298. 6-[2-({2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl}methyl)-4-methoxyphenyl]hex-5-ynoic acid; 6-[2-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methyl]-4-methoxyphenyl]hex-5-ynoic acid; 6-{2-[(2,4-Diamino-5-Methylpyrido[2,3-D]pyrimidin-6-Yl)methyl]-4-Methoxyphenyl}hex-5-Ynoic Acid ...
MW:     405.449720 g/mol MF: C22H23N5O3
IUPAC name: 6-[2-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methy...
Create Date: 2006-04-29
CID: 6481081

2299. 5-[2-({2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl}methyl)-4-methoxyphenyl]pent-4-ynoic acid; 5-[2-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methyl]-4-methoxyphenyl]pent-4-ynoic acid; AC1O5APU ...
MW:     391.423140 g/mol MF: C21H21N5O3
IUPAC name: 5-[2-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methy...
Create Date: 2006-04-29
CID: 6481080

2300. 7-[3-({2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl}methyl)-4-methoxyphenyl]hept-6-ynoic acid; 7-[3-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methyl]-4-methoxyphenyl]hept-6-ynoic acid; AC1O5APR ...
MW:     419.476300 g/mol MF: C23H25N5O3
IUPAC name: 7-[3-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methy...
Create Date: 2006-04-29
CID: 6481079

2301. 6-[3-({2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl}methyl)-4-methoxyphenyl]hex-5-ynoic acid; 6-[3-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methyl]-4-methoxyphenyl]hex-5-ynoic acid; AC1O5APO ...
MW:     405.449720 g/mol MF: C22H23N5O3
IUPAC name: 6-[3-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methy...
Create Date: 2006-04-29
CID: 6481078

2302. 5-[3-({2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl}methyl)-4-methoxyphenyl]pent-4-ynoic acid; 5-[3-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methyl]-4-methoxyphenyl]pent-4-ynoic acid; AC1O5APL ...
MW:     391.423140 g/mol MF: C21H21N5O3
IUPAC name: 5-[3-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methy...
Create Date: 2006-04-29
CID: 6481077

2303. GW0385 analog 5; AC1NX476; BDBM4690 ...
MW:     683.768440 g/mol MF: C34H41N3O10S
IUPAC name: [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ...
Create Date: 2005-08-01
CID: 5743189

2304. GW0385 analog 4; AC1NX474; BDBM4689 ...
MW:     702.834680 g/mol MF: C34H42N2O10S2
IUPAC name: [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ...
Create Date: 2005-08-01
CID: 5743188

2305. GW0385 analog 2; AC1NX472; BDBM4687 ...
MW:     691.788900 g/mol MF: C33H45N3O11S
IUPAC name: [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ...
Create Date: 2005-08-01
CID: 5743187

2306. AC1NUZFN; Carbocyclic Analogue 50; BDBM5000 ...
MW:     366.494960 g/mol MF: C20H34N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-[(3S)-1-cyclohexylpentan-3-...
Create Date: 2005-08-01
CID: 5464655

2307. AC1NUZFK; Carbocyclic Analogue 49; BDBM4999 ...
MW:     352.468380 g/mol MF: C19H32N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-[(2S)-1-cyclohexylbutan-2-y...
Create Date: 2005-08-01
CID: 5464654

2308. AC1NS7GN; Flavopiridol analogue 21; BDBM5712 ...
MW:     433.905200 g/mol MF: C21H20ClNO5S
IUPAC name: 2-(2-chlorophenyl)sulfanyl-5,7-dihydroxy-8-[(3R,4S)-3-hydrox...
Create Date: 2006-01-30
CID: 5329716

2309. 3-substituted indolin-2-one 9d; SU5402 analog 9d; AC1NS65E ...
MW:     416.469060 g/mol MF: C25H24N2O4
IUPAC name: 3-[2-[(Z)-[6-(3-ethoxyphenyl)-2-oxo-1H-indol-3-ylidene]methy...
Create Date: 2006-01-30
CID: 5329137

2310. 3-substituted indolin-2-one 9c; SU5402 analog 9c; AC1NS65B ...
MW:     402.442480 g/mol MF: C24H22N2O4
IUPAC name: 3-[2-[(Z)-[6-(3-methoxyphenyl)-2-oxo-1H-indol-3-ylidene]meth...
Create Date: 2006-01-30
CID: 5329136

2311. 3-substituted indolin-2-one 9b; SU5402 analog 9b; AC1NS658 ...
MW:     375.216600 g/mol MF: C17H15BrN2O3
IUPAC name: 3-[2-[(Z)-(5-bromo-2-oxo-1H-indol-3-ylidene)methyl]-4-methyl...
Create Date: 2006-01-30
CID: 5329135

2312. 3-substituted indolin-2-one 9a; SU5402 analog 9a; AC1NS655 ...
MW:     310.347120 g/mol MF: C18H18N2O3
IUPAC name: 3-[4-methyl-2-[(Z)-(4-methyl-2-oxo-1H-indol-3-ylidene)methyl...
Create Date: 2006-01-30
CID: 5329134

2313. Balanol Benzophenone Ester Analog (+/-)8; AC1NS3KB; BDBM3250 ...
MW:     535.498800 g/mol MF: C28H25NO10
IUPAC name: [2-[(4-hydroxybenzoyl)amino]cyclopentyl] 3,5-dihydroxy-4-(2-...
Create Date: 2006-01-30
CID: 5328009

2314. 8-Methoxy-1,4-dimethylquinolin-2(1H)-one; 63791-96-8; casimiroin analogue, 1f ...
MW:     203.237120 g/mol MF: C12H13NO2
IUPAC name: 8-methoxy-1,4-dimethylquinolin-2-one
Create Date: 2006-01-25
CID: 5324988

2315. CHEMBL142049; Quinuclidine analogue, 1; AC1N8XJ4 ...
MW:     150.220860 g/mol MF: C9H14N2
IUPAC name: N,N-dimethyl-2-pyridin-3-ylethanamine
Create Date: 2005-09-14
CID: 4401657

2316. STX-681; 4-[(3-BROMO-4-O-SULFAMOYLBENZYL)(4-CYANOPHENYL)AMINO]-4H-[1,2,4]-TRIAZOLE; 4TR ...
MW:     449.281820 g/mol MF: C16H13BrN6O3S
IUPAC name: [2-bromo-4-[[4-cyano-N-(1,2,4-triazol-4-yl)anilino]methyl]ph...
Create Date: 2005-09-14
CID: 4369414

2317. 4TZ; 4-[(4-O-SULFAMOYLBENZYL)(4-CYANOPHENYL)AMINO]-4H-[1,2,4]-TRIAZOLE; 4-{[(4-CYANOPHENYL)(4H-1,2,4-TRIAZOL-4-YL)AMINO]METHYL}PHENYL SULFAMATE ...
MW:     370.385760 g/mol MF: C16H14N6O3S
IUPAC name: [4-[[4-cyano-N-(1,2,4-triazol-4-yl)anilino]methyl]phenyl] su...
Create Date: 2005-09-14
CID: 4369413

2318. 69079-54-5; N-[2-[(2-hydroxy-3-naphthalen-1-yloxypropyl)amino]ethyl]-5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanamide; Biotin-propranolol analog ...
MW:     486.626860 g/mol MF: C25H34N4O4S
IUPAC name: N-[2-[(2-hydroxy-3-naphthalen-1-yloxypropyl)amino]ethyl]-5-(...
Create Date: 2005-09-12
CID: 3986857

2319. AC1MHDVD; DABO Thio Analogue 5b; BDBM2433 ...
MW:     246.328060 g/mol MF: C13H14N2OS
IUPAC name: 5-methyl-6-[(3-methylphenyl)methyl]-2-sulfanylidene-1H-pyrim...
Create Date: 2005-08-01
CID: 3001592

2320. 6-benzyl-4-hydroxy-2-mercapto-5-methylpyrimidine; 6-BENZYL-5-METHYL-2-THIOXO-2,3-DIHYDROPYRIMIDIN-4(1H)-ONE; 169772-16-1 ...
MW:     232.301480 g/mol MF: C12H12N2OS
IUPAC name: 6-benzyl-5-methyl-2-sulfanylidene-1H-pyrimidin-4-one
Create Date: 2005-08-01
CID: 3001591

2321. 4-hydroxy-2-mercapto-6-(3'-methylbenzyl)pyrimidine; 169772-15-0; AC1MHDVB ...
MW:     232.301480 g/mol MF: C12H12N2OS
IUPAC name: 6-[(3-methylphenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-on...
Create Date: 2005-08-01
CID: 3001590

2322. 6-Amino-1-benzyl-5-ethylamino-1H-pyrimidine-2,4-dione; ZINC03276805; Analogue of 1a, 12b ...
MW:     260.291740 g/mol MF: C13H16N4O2
IUPAC name: 6-amino-1-benzyl-5-(ethylamino)pyrimidine-2,4-dione
Create Date: 2005-07-15
CID: 2392273

2323. N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-[(phenylsulfonyl)amino]benzamide; SMR000076964; Sulfonamide analogue, 2 ...
MW:     388.463940 g/mol MF: C17H16N4O3S2
IUPAC name: 4-(benzenesulfonamido)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benz...
Create Date: 2005-07-15
CID: 2210290

2324. 5,8-dimethoxy-1,4-dimethylquinolin-2-one; 5,8-Dimethoxy-1,4-dimethylquinolin-2(1H)-one; ST4106238 ...
MW:     233.263100 g/mol MF: C13H15NO3
IUPAC name: 5,8-dimethoxy-1,4-dimethylquinolin-2-one
Create Date: 2005-07-11
CID: 1504717

2325. FAAH inhibitor 1; 326866-17-5; ST50046401 ...
MW:     497.652720 g/mol MF: C24H23N3O3S3
IUPAC name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-thiophen-2-yl...
Create Date: 2005-07-10
CID: 1190414

2326. 8-Methoxy-4-methylquinolin-2(1H)-one; 2-Hydroxy-4-methyl-8-methoxyquinoline; 30198-01-7 ...
MW:     189.210540 g/mol MF: C11H11NO2
IUPAC name: 8-methoxy-4-methyl-1H-quinolin-2-one
Create Date: 2005-07-08
CID: 782123

2327. 3-(4-CHLOROPHENYL)QUINOXALINE-5-CARBOXAMIDE; 2-(4-CHLOROPHENYL)-5-QUINOXALINECARBOXAMIDE; 1wok ...
MW:     283.712400 g/mol MF: C15H10ClN3O
IUPAC name: 3-(4-chlorophenyl)quinoxaline-5-carboxamide
Create Date: 2005-06-24
CID: 657038

2328. Thialbarbitone oxygen analogue-permethylated; AC1LDDH6; DDVUXNPABOYZGT-UHFFFAOYSA-N ...
MW:     276.330900 g/mol MF: C15H20N2O3
IUPAC name: 5-cyclohex-2-en-1-yl-1,3-dimethyl-5-prop-2-enyl-1,3-diazinan...
Create Date: 2005-03-27
CID: 616557

2329. CHEMBL432329; carbocyclic analogue 19; AC1LA28U ...
MW:     312.364760 g/mol MF: C14H24N4O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-[(N'-methylcarbamimidoyl)amino]-3-p...
Create Date: 2005-08-01
CID: 505926

2330. CHEMBL53507; carbocyclic analogue 16; AC1LA28R ...
MW:     283.323540 g/mol MF: C13H21N3O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-(aminomethylideneamino)-3-propoxycy...
Create Date: 2005-08-01
CID: 505925

2331. carbocyclic analogue 14; AC1LA28O; CHEMBL52862 ...
MW:     292.351900 g/mol MF: C11H20N2O5S
IUPAC name: (3R,4R,5S)-5-amino-4-(methanesulfonamido)-3-propoxycyclohexe...
Create Date: 2005-08-01
CID: 505924

2332. carbocyclic analogue 13; AC1LA28L; CHEMBL53768 ...
MW:     270.324780 g/mol MF: C13H22N2O4
IUPAC name: (3R,4R,5S)-5-amino-4-(propanoylamino)-3-propoxycyclohexene-1...
Create Date: 2005-08-01
CID: 505923

2333. (3R,4R,5S)-5-amino-3-propoxy-4-[(2,2,2-trifluoroacetyl)amino]cyclohexene-1-carboxylic acid; carbocyclic analogue 12; AC1LA28I ...
MW:     310.269590 g/mol MF: C12H17F3N2O4
IUPAC name: (3R,4R,5S)-5-amino-3-propoxy-4-[(2,2,2-trifluoroacetyl)amino...
Create Date: 2005-08-01
CID: 505922

2334. AC1LARRM; Carbocyclic Analogue 22; BDBM5016 ...
MW:     298.377940 g/mol MF: C15H26N2O4
IUPAC name: (3R,4R,5S,6R)-4-acetamido-5-amino-6-methyl-3-pentan-3-yloxyc...
Create Date: 2005-08-01
CID: 493878

2335. AC1LARRJ; Carbocyclic Analogue 30; BDBM5015 ...
MW:     302.341823 g/mol MF: C14H23FN2O4
IUPAC name: (3S,4R,5S)-4-acetamido-5-amino-2-fluoro-3-pentan-3-yloxycycl...
Create Date: 2005-08-01
CID: 493877

2336. AC1LARRD; Carbocyclic Analogue 61; BDBM5011 ...
MW:     312.364760 g/mol MF: C14H24N4O4
IUPAC name: (3R,4R,5S)-4-acetamido-3-[(2R)-butan-2-yl]oxy-5-(diaminometh...
Create Date: 2005-08-01
CID: 493875

2337. Carbocyclic Analogue 60; AC1LARR7; CHEMBL81790 ...
MW:     312.364760 g/mol MF: C14H24N4O4
IUPAC name: (3R,4R,5S)-4-acetamido-3-butoxy-5-(diaminomethylideneamino)c...
Create Date: 2005-08-01
CID: 493873

2338. Carbocyclic Analogue 58; AC1LARR1; BDBM5008 ...
MW:     256.258440 g/mol MF: C10H16N4O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-(diaminomethylideneamino)-3-hydroxy...
Create Date: 2005-08-01
CID: 493871

2339. (3R,4R,5S)-4-acetamido-5-amino-3-[3-(4-phenylphenyl)propoxy]cyclohexene-1-carboxylic acid; AC1LARQY; Carbocyclic Analogue 57 ...
MW:     408.490120 g/mol MF: C24H28N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-[3-(4-phenylphenyl)propoxy]...
Create Date: 2005-08-01
CID: 493870

2340. AC1LARQV; Carbocyclic Analogue 56; BDBM5006 ...
MW:     464.596440 g/mol MF: C28H36N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-(1,7-diphenylheptan-4-yloxy...
Create Date: 2005-08-01
CID: 493869

2341. AC1LARQS; Carbocyclic Analogue 55; BDBM5005 ...
MW:     408.490120 g/mol MF: C24H28N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-(1,3-diphenylpropan-2-yloxy...
Create Date: 2005-08-01
CID: 493868

2342. AC1LARQM; Carbocyclic Analogue 54; CHEMBL79499 ...
MW:     360.447320 g/mol MF: C20H28N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-[(3R)-1-phenylpentan-3-yl]o...
Create Date: 2005-08-01
CID: 493866

2343. AC1LARQJ; Carbocyclic Analogue 52; BDBM5002 ...
MW:     304.341000 g/mol MF: C16H20N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-phenylmethoxycyclohexene-1-...
Create Date: 2005-08-01
CID: 493865

2344. AC1LARQA; Carbocyclic Analogue 47; BDBM4997 ...
MW:     354.484260 g/mol MF: C19H34N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-[(3S)-decan-3-yl]oxycyclohe...
Create Date: 2005-08-01
CID: 493860

2345. Carbocyclic Analogue 46; AC1LARQ4; CHEMBL81777 ...
MW:     296.362060 g/mol MF: C15H24N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-[(3R)-hex-5-en-3-yl]oxycycl...
Create Date: 2005-08-01
CID: 493858

2346. Carbocyclic Analogue 41; AC1LARQ1; BDBM4990 ...
MW:     354.484260 g/mol MF: C19H34N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-decoxycyclohexene-1-carboxy...
Create Date: 2005-08-01
CID: 493857

2347. AC1LARPY; Carbocyclic Analogue 40; BDBM4989 ...
MW:     340.457680 g/mol MF: C18H32N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-nonoxycyclohexene-1-carboxy...
Create Date: 2005-08-01
CID: 493856

2348. AC1LARPV; Carbocyclic Analogue 39; CHEMBL81637 ...
MW:     326.431100 g/mol MF: C17H30N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-octoxycyclohexene-1-carboxy...
Create Date: 2005-08-01
CID: 493855

2349. AC1LARPS; Carbocyclic Analogue 38; CHEMBL81953 ...
MW:     312.404520 g/mol MF: C16H28N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-heptoxycyclohexene-1-carbox...
Create Date: 2005-08-01
CID: 493854

2350. AC1LARPP; Carbocyclic Analogue 37; CHEMBL82771 ...
MW:     298.377940 g/mol MF: C15H26N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-hexoxycyclohexene-1-carboxy...
Create Date: 2005-08-01
CID: 493853

2351. AC1LARPM; Carbocyclic Analogue 36; CHEMBL83932 ...
MW:     284.351360 g/mol MF: C14H24N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-pentoxycyclohexene-1-carbox...
Create Date: 2005-08-01
CID: 493852

2352. CHEMBL81717; Guanidino-Oseltamivir Carboxylicacid; Carbocyclic Analogue 63 ...
MW:     326.391340 g/mol MF: C15H26N4O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-(diaminomethylideneamino)-3-pentan-...
Create Date: 2005-08-01
CID: 490476

2353. D-Cysteine Analog 17i; AC1LAH8D; BDBM9638 ...
MW:     619.755980 g/mol MF: C27H37N7O6S2
IUPAC name: N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-[[(2S)-2-(methanesulfona...
Create Date: 2005-08-01
CID: 488079

2354. D-Cysteine Analog 16i; AC1LAH8A; BDBM9630 ...
MW:     603.756580 g/mol MF: C27H37N7O5S2
IUPAC name: N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-[[(2S)-2-(methanesulfona...
Create Date: 2005-08-01
CID: 488078

2355. GW0385 analog 3; AC1LA2NJ; BDBM4688 ...
MW:     719.842060 g/mol MF: C35H49N3O11S
IUPAC name: ethyl N-[6-[[(2R,3S)-3-[[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydr...
Create Date: 2005-08-01
CID: 480433

2356. Carbocyclic Analogue 44; AC1LA2CP; BDBM4993 ...
MW:     270.324780 g/mol MF: C13H22N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-[(2S)-butan-2-yl]oxycyclohe...
Create Date: 2005-08-01
CID: 480300

2357. Carbocyclic Analogue 31; AC1LA29M; CHEMBL81159 ...
MW:     214.218460 g/mol MF: C9H14N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-hydroxycyclohexene-1-carbox...
Create Date: 2005-08-01
CID: 480263

2358. Carbocyclic Analogue 42; AC1LA29D; CHEMBL79524 ...
MW:     270.324780 g/mol MF: C13H22N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-(2-methylpropoxy)cyclohexen...
Create Date: 2005-08-01
CID: 480260

2359. Carbocyclic Analogue 35; AC1LA29A; CHEMBL79908 ...
MW:     270.324780 g/mol MF: C13H22N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-butoxycyclohexene-1-carboxy...
Create Date: 2005-08-01
CID: 480259

2360. CHEMBL309419; Carbocyclic Analogue 33; AC1LA294 ...
MW:     242.271620 g/mol MF: C11H18N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-ethoxycyclohexene-1-carboxy...
Create Date: 2005-08-01
CID: 480257

2361. Carbocyclic Analogue 32; AC1LA291; BDBM4981 ...
MW:     228.245040 g/mol MF: C10H16N2O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-methoxycyclohexene-1-carbox...
Create Date: 2005-08-01
CID: 480256

2362. N-(1H-benzimidazol-2-yl)-3-[[(4R,5S,6S,7R)-3-[[3-(1H-benzimidazol-2-ylcarbamoyl)phenyl]methyl]-4-benzyl-7-hexyl-5,6-dihydroxy-2-oxo-1,3-diazepan-1-yl]methyl]benzamide; AC1LAQE6; SD146 Analog 12 ...
MW:     818.961200 g/mol MF: C48H50N8O5
IUPAC name: N-(1H-benzimidazol-2-yl)-3-[[(4R,5S,6S,7R)-3-[[3-(1H-benzimi...
Create Date: 2005-08-01
CID: 473096

2363. AC1LAQE3; SD146 Analog 11; BDBM7090 ...
MW:     790.908040 g/mol MF: C46H46N8O5
IUPAC name: N-(1H-benzimidazol-2-yl)-3-[[(4R,5S,6S,7R)-3-[[3-(1H-benzimi...
Create Date: 2005-08-01
CID: 473095

2364. N-(1H-benzimidazol-2-yl)-3-[[(4R,5S,6S,7R)-3-[[3-(1H-benzimidazol-2-ylcarbamoyl)phenyl]methyl]-4-benzyl-7-ethyl-5,6-dihydroxy-2-oxo-1,3-diazepan-1-yl]methyl]benzamide; AC1LAQE0; SD146 Analog 10 ...
MW:     762.854880 g/mol MF: C44H42N8O5
IUPAC name: N-(1H-benzimidazol-2-yl)-3-[[(4R,5S,6S,7R)-3-[[3-(1H-benzimi...
Create Date: 2005-08-01
CID: 473094

2365. N-(1H-benzimidazol-2-yl)-3-[[(4R,5S,6S,7R)-3-[[3-(1H-benzimidazol-2-ylcarbamoyl)phenyl]methyl]-5,6-dihydroxy-4,7-bis[(4-methoxyphenyl)methyl]-2-oxo-1,3-diazepan-1-yl]methyl]benzamide; AC1LAQDX; SD146 Analog 9 ...
MW:     884.976220 g/mol MF: C51H48N8O7
IUPAC name: N-(1H-benzimidazol-2-yl)-3-[[(4R,5S,6S,7R)-3-[[3-(1H-benzimi...
Create Date: 2005-08-01
CID: 473093

2366. N-(1H-benzimidazol-2-yl)-3-[[(4R,5S,6S,7R)-3-[[3-(1H-benzimidazol-2-ylcarbamoyl)phenyl]methyl]-5,6-dihydroxy-4,7-bis[(4-hydroxyphenyl)methyl]-2-oxo-1,3-diazepan-1-yl]methyl]benzamide; AC1LAQDU; SD146 Analog 7 ...
MW:     856.923060 g/mol MF: C49H44N8O7
IUPAC name: N-(1H-benzimidazol-2-yl)-3-[[(4R,5S,6S,7R)-3-[[3-(1H-benzimi...
Create Date: 2005-08-01
CID: 473092

2367. N-(1H-benzimidazol-2-yl)-3-[[(4R,5S,6S,7R)-3-[[3-(1H-benzimidazol-2-ylcarbamoyl)phenyl]methyl]-4,7-bis[(4-dimethylaminophenyl)methyl]-5,6-dihydroxy-2-oxo-1,3-diazepan-1-yl]methyl]benzamide; AC1LAQDR; SD146 Analog 6 ...
MW:     911.059860 g/mol MF: C53H54N10O5
IUPAC name: N-(1H-benzimidazol-2-yl)-3-[[(4R,5S,6S,7R)-3-[[3-(1H-benzimi...
Create Date: 2005-08-01
CID: 473091

2368. N-(1H-benzimidazol-2-yl)-3-[[(4R,5S,6S,7R)-4,7-bis[(4-aminophenyl)methyl]-3-[[3-(1H-benzimidazol-2-ylcarbamoyl)phenyl]methyl]-5,6-dihydroxy-2-oxo-1,3-diazepan-1-yl]methyl]benzamide; AC1LAQDP; SD146 Analog 5 ...
MW:     854.953540 g/mol MF: C49H46N10O5
IUPAC name: N-(1H-benzimidazol-2-yl)-3-[[(4R,5S,6S,7R)-4,7-bis[(4-aminop...
Create Date: 2005-08-01
CID: 473090

2369. N-(1H-benzimidazol-2-yl)-3-[[(4R,5S,6S,7R)-3-[[3-(1H-benzimidazol-2-ylcarbamoyl)phenyl]methyl]-4,7-dicyclohexyl-5,6-dihydroxy-2-oxo-1,3-diazepan-1-yl]methyl]benzamide; AC1LAQDN; SD146 Analog 4 ...
MW:     808.966380 g/mol MF: C47H52N8O5
IUPAC name: N-(1H-benzimidazol-2-yl)-3-[[(4R,5S,6S,7R)-3-[[3-(1H-benzimi...
Create Date: 2005-08-01
CID: 473089

2370. N-(1H-benzimidazol-2-yl)-3-[[(4R,5S,6S,7R)-3-[[3-(1H-benzimidazol-2-ylcarbamoyl)phenyl]methyl]-4,7-dihexyl-5,6-dihydroxy-2-oxo-1,3-diazepan-1-yl]methyl]benzamide; AC1LAQDL; SD146 Analog 3 ...
MW:     812.998140 g/mol MF: C47H56N8O5
IUPAC name: N-(1H-benzimidazol-2-yl)-3-[[(4R,5S,6S,7R)-3-[[3-(1H-benzimi...
Create Date: 2005-08-01
CID: 473088

2371. AC1LAQDJ; SD146 Analog 2; BDBM7081 ...
MW:     756.891820 g/mol MF: C43H48N8O5
IUPAC name: N-(1H-benzimidazol-2-yl)-3-[[(4R,5S,6S,7R)-3-[[3-(1H-benzimi...
Create Date: 2005-08-01
CID: 473087

2372. N-(1H-benzimidazol-2-yl)-3-[[(4R,5S,6S,7R)-3-[[3-(1H-benzimidazol-2-ylcarbamoyl)phenyl]methyl]-4,7-diethyl-5,6-dihydroxy-2-oxo-1,3-diazepan-1-yl]methyl]benzamide; AC1LAQDH; SD146 Analog 1 ...
MW:     700.785500 g/mol MF: C39H40N8O5
IUPAC name: N-(1H-benzimidazol-2-yl)-3-[[(4R,5S,6S,7R)-3-[[3-(1H-benzimi...
Create Date: 2005-08-01
CID: 473086

2373. CHEMBL293961; 1-(2,6-difluorobenzyl)-2-(2,6-difluorophenyl)-4-methyl-1h-benzimidazole; 199594-65-5 ...
MW:     370.342873 g/mol MF: C21H14F4N2
IUPAC name: 2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl]-4-meth...
Create Date: 2005-08-01
CID: 468848

2374. 199594-59-7; CHEMBL58581; 1-(2,6-difluorobenzyl)-2-(2,6-difluorophenyl)-1h-benzimidazole ...
MW:     356.316293 g/mol MF: C20H12F4N2
IUPAC name: 2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl]benzimi...
Create Date: 2005-08-01
CID: 468847

2375. Thiazole disulfide analog; AC1LA77B; CHEMBL121095 ...
MW:     350.503760 g/mol MF: C10H14N4O2S4
IUPAC name: N-[2-[(5-acetamido-4,5-dihydro-1,3-thiazol-2-yl)disulfanyl]-...
Create Date: 2005-08-01
CID: 462943

2376. Naphthyl disulfide analog; SCHEMBL224824; AC1LA775 ...
MW:     348.484440 g/mol MF: C20H16N2S2
IUPAC name: 3-[(3-aminonaphthalen-2-yl)disulfanyl]naphthalen-2-amine
Create Date: 2005-08-01
CID: 462941

2377. 4-amino-1-[(2S,5R)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one; L-d4C, thiophene analog; AC1LA73T ...
MW:     225.267540 g/mol MF: C9H11N3O2S
IUPAC name: 4-amino-1-[(2S,5R)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-y...
Create Date: 2005-08-01
CID: 462900

2378. CHEMBL129094; .beta.-L-ddSC; L-ddC, thiophene analog ...
MW:     227.283420 g/mol MF: C9H13N3O2S
IUPAC name: 4-amino-1-[(2S,5R)-5-(hydroxymethyl)thiolan-2-yl]pyrimidin-2...
Create Date: 2005-08-01
CID: 462898

2379. 5FddC, thiophene analog; AC1LA6XQ; SCHEMBL9122186 ...
MW:     245.273883 g/mol MF: C9H12FN3O2S
IUPAC name: 4-amino-5-fluoro-1-[(2R,5S)-5-(hydroxymethyl)thiolan-2-yl]py...
Create Date: 2005-08-01
CID: 462827

2380. D-Cysteine Analog 13d; AC1LA5UR; BDBM9617 ...
MW:     561.734760 g/mol MF: C32H39N3O4S
IUPAC name: 2-[(2R,3S)-3-[[(2S)-2-acetamido-3-phenylsulfanylpropanoyl]am...
Create Date: 2005-08-01
CID: 462312

2381. D-Cysteine Analog 18k; AC1LA5UO; BDBM9648 ...
MW:     664.232320 g/mol MF: C31H38ClN3O7S2
IUPAC name: N-tert-butyl-2-[(2R,3S)-3-[[(2S)-3-(4-chlorophenyl)sulfonyl-...
Create Date: 2005-08-01
CID: 462311

2382. D-Cysteine Analog 18j; AC1LA5UL; BDBM9647 ...
MW:     659.813240 g/mol MF: C32H41N3O8S2
IUPAC name: N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-[[(2S)-2-(methanesulfona...
Create Date: 2005-08-01
CID: 462310

2383. D-Cysteine Analog 18h; AC1LA5UI; BDBM9646 ...
MW:     697.785230 g/mol MF: C32H38F3N3O7S2
IUPAC name: N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-[[(2S)-2-(methanesulfona...
Create Date: 2005-08-01
CID: 462309

2384. D-Cysteine Analog 18g; AC1LA5UF; BDBM9645 ...
MW:     647.777723 g/mol MF: C31H38FN3O7S2
IUPAC name: N-tert-butyl-2-[(2R,3S)-3-[[(2S)-3-(4-fluorophenyl)sulfonyl-...
Create Date: 2005-08-01
CID: 462308

2385. (S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]carbonyl]phenyl]-2-hydroxy-1-(phenylmethyl)propyl]-2-[(methylsulfonyl)amino]-3-(2-pyridylsulfonyl)propanamide; D-Cysteine Analog 18f; AC1LA5UC ...
MW:     630.775320 g/mol MF: C30H38N4O7S2
IUPAC name: N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-[[(2S)-2-(methanesulfona...
Create Date: 2005-08-01
CID: 462307

2386. D-Cysteine Analog 18e; AC1LA5U9; BDBM9643 ...
MW:     679.845940 g/mol MF: C35H41N3O7S2
IUPAC name: N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-[[(2S)-2-(methanesulfona...
Create Date: 2005-08-01
CID: 462306

2387. D-Cysteine Analog 18d; AC1LA5U6; BDBM9642 ...
MW:     629.787260 g/mol MF: C31H39N3O7S2
IUPAC name: 2-[(2R,3S)-3-[[(2S)-3-(benzenesulfonyl)-2-(methanesulfonamid...
Create Date: 2005-08-01
CID: 462305

2388. D-Cysteine Analog 18c; AC1LA5U3; BDBM9641 ...
MW:     679.845940 g/mol MF: C35H41N3O7S2
IUPAC name: N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-[[(2S)-2-(methanesulfona...
Create Date: 2005-08-01
CID: 462304

2389. D-Cysteine Analog 18b; AC1LA5U0; BDBM9640 ...
MW:     680.834000 g/mol MF: C34H40N4O7S2
IUPAC name: N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-[[(2S)-2-(methanesulfona...
Create Date: 2005-08-01
CID: 462303

2390. D-Cysteine Analog 18a; AC1LA5TX; BDBM9639 ...
MW:     643.813840 g/mol MF: C32H41N3O7S2
IUPAC name: 2-[(2R,3S)-3-[[(2S)-3-benzylsulfonyl-2-(methanesulfonamido)p...
Create Date: 2005-08-01
CID: 462302

2391. D-Cysteine Analog 17h; AC1LA5TR; BDBM9637 ...
MW:     681.785830 g/mol MF: C32H38F3N3O6S2
IUPAC name: N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-[[(2S)-2-(methanesulfona...
Create Date: 2005-08-01
CID: 462300

2392. D-Cysteine Analog 17g; AC1LA5TO; BDBM9636 ...
MW:     631.778323 g/mol MF: C31H38FN3O6S2
IUPAC name: N-tert-butyl-2-[(2R,3S)-3-[[(2S)-3-(4-fluorophenyl)sulfinyl-...
Create Date: 2005-08-01
CID: 462299

2393. D-Cysteine Analog 17e; AC1LA5TI; BDBM9634 ...
MW:     663.846540 g/mol MF: C35H41N3O6S2
IUPAC name: N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-[[(2S)-2-(methanesulfona...
Create Date: 2005-08-01
CID: 462297

2394. D-Cysteine Analog 17d; AC1LA5TF; BDBM9633 ...
MW:     613.787860 g/mol MF: C31H39N3O6S2
IUPAC name: 2-[(2R,3S)-3-[[(2S)-3-(benzenesulfinyl)-2-(methanesulfonamid...
Create Date: 2005-08-01
CID: 462296

2395. D-Cysteine Analog 17c; AC1LA5TC; BDBM9632 ...
MW:     663.846540 g/mol MF: C35H41N3O6S2
IUPAC name: N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-[[(2S)-2-(methanesulfona...
Create Date: 2005-08-01
CID: 462295

2396. D-Cysteine Analog 16j; AC1LA5T9; BDBM9631 ...
MW:     627.814440 g/mol MF: C32H41N3O6S2
IUPAC name: N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-[[(2S)-2-(methanesulfona...
Create Date: 2005-08-01
CID: 462294

2397. D-Cysteine Analog 16g; AC1LA5T3; BDBM9628 ...
MW:     615.778923 g/mol MF: C31H38FN3O5S2
IUPAC name: N-tert-butyl-2-[(2R,3S)-3-[[(2S)-3-(4-fluorophenyl)sulfanyl-...
Create Date: 2005-08-01
CID: 462292

2398. D-Cysteine Analog 16h; AC1LA5T0; BDBM9629 ...
MW:     665.786430 g/mol MF: C32H38F3N3O5S2
IUPAC name: N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-[[(2S)-2-(methanesulfona...
Create Date: 2005-08-01
CID: 462291

2399. D-Cysteine Analog 16f; AC1LA5SX; BDBM9627 ...
MW:     598.776520 g/mol MF: C30H38N4O5S2
IUPAC name: N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-[[(2S)-2-(methanesulfona...
Create Date: 2005-08-01
CID: 462290

2400. D-Cysteine Analog 16e; AC1LA5SU; BDBM9626 ...
MW:     647.847140 g/mol MF: C35H41N3O5S2
IUPAC name: N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-[[(2S)-2-(methanesulfona...
Create Date: 2005-08-01
CID: 462289

2401. D-Cysteine Analog 16d; AC1LA5SR; BDBM9625 ...
MW:     597.788460 g/mol MF: C31H39N3O5S2
IUPAC name: N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-[[(2S)-2-(methanesulfona...
Create Date: 2005-08-01
CID: 462288

2402. D-Cysteine Analog 16c; AC1LA5SO; BDBM9624 ...
MW:     647.847140 g/mol MF: C35H41N3O5S2
IUPAC name: N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-[[(2S)-2-(methanesulfona...
Create Date: 2005-08-01
CID: 462287

2403. D-Cysteine Analog 16b; AC1LA5SL; BDBM9623 ...
MW:     648.835200 g/mol MF: C34H40N4O5S2
IUPAC name: N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-[[(2S)-2-(methanesulfona...
Create Date: 2005-08-01
CID: 462286

2404. D-Cysteine Analog 16a; AC1LA5SI; BDBM9622 ...
MW:     611.815040 g/mol MF: C32H41N3O5S2
IUPAC name: 2-[(2R,3S)-3-[[(2S)-3-benzylsulfanyl-2-(methanesulfonamido)p...
Create Date: 2005-08-01
CID: 462285

2405. D-Cysteine Analog 15d; AC1LA5SF; BDBM9621 ...
MW:     593.733560 g/mol MF: C32H39N3O6S
IUPAC name: 2-[(2R,3S)-3-[[(2S)-2-acetamido-3-(benzenesulfonyl)propanoyl...
Create Date: 2005-08-01
CID: 462284

2406. D-Cysteine Analog 14b; AC1LA5SC; BDBM9618 ...
MW:     628.780900 g/mol MF: C35H40N4O5S
IUPAC name: 2-[(2R,3S)-3-[[(2S)-2-acetamido-3-quinolin-2-ylsulfinylpropa...
Create Date: 2005-08-01
CID: 462283

2407. D-Cysteine Analog 13b; AC1LA5S9; BDBM9615 ...
MW:     612.781500 g/mol MF: C35H40N4O4S
IUPAC name: 2-[(2R,3S)-3-[[(2S)-2-acetamido-3-quinolin-2-ylsulfanylpropa...
Create Date: 2005-08-01
CID: 462282

2408. ethyl 3-(4-fluorophenyl)-6,7-dihydro-5H-pyrrolizine-2-carboxylate; Pyrrolizine-6COOH analog; AC1LA3R3 ...
MW:     273.302143 g/mol MF: C16H16FNO2
IUPAC name: ethyl 3-(4-fluorophenyl)-6,7-dihydro-5H-pyrrolizine-2-carbox...
Create Date: 2005-08-01
CID: 461166

2409. 93806-87-2; L-alanylpolyoxin C analog; AC1L9V38 ...
MW:     372.330600 g/mol MF: C14H20N4O8
IUPAC name: 2-[2-aminopropanoyl(methyl)amino]-2-[(2R,3S,4R,5R)-5-(2,4-di...
Create Date: 2005-08-01
CID: 456530

2410. 93806-75-8; L-threonyl UPOC analog; AC1L9V2Q ...
MW:     388.330000 g/mol MF: C14H20N4O9
IUPAC name: 2-[(2-amino-3-hydroxybutanoyl)amino]-2-[(2R,3S,4R,5R)-5-(2,4...
Create Date: 2005-08-01
CID: 456524

2411. Haloperidol Et2N analog; AC1L9TVH; 4-[4-[3-(Diethylamino)phenyl]-4-hydroxypiperidinol]-4'-fluorobutyrophenone ...
MW:     412.540123 g/mol MF: C25H33FN2O2
IUPAC name: 4-[4-[3-(diethylamino)phenyl]-4-hydroxypiperidin-1-yl]-1-(4-...
Create Date: 2005-08-01
CID: 455917

2412. D-Cysteine Analog 15c; AC1L9TAK; BDBM9620 ...
MW:     643.792240 g/mol MF: C36H41N3O6S
IUPAC name: 2-[(2R,3S)-3-[[(2S)-2-acetamido-3-naphthalen-2-ylsulfonylpro...
Create Date: 2005-08-01
CID: 455655

2413. D-Cysteine Analog 13c; AC1L9TAH; BDBM9616 ...
MW:     611.793440 g/mol MF: C36H41N3O4S
IUPAC name: 2-[(2R,3S)-3-[[(2S)-2-acetamido-3-naphthalen-2-ylsulfanylpro...
Create Date: 2005-08-01
CID: 455654

2414. D-Cysteine Analog 15b; AC1L9TAE; BDBM9619 ...
MW:     644.780300 g/mol MF: C35H40N4O6S
IUPAC name: 2-[(2R,3S)-3-[[(2S)-2-acetamido-3-quinolin-2-ylsulfonylpropa...
Create Date: 2005-08-01
CID: 455653

2415. D-Cysteine Analog 13a; AC1L9TAB; CHEMBL31510 ...
MW:     575.761340 g/mol MF: C33H41N3O4S
IUPAC name: 2-[(2R,3S)-3-[[(2S)-2-acetamido-3-benzylsulfanylpropanoyl]am...
Create Date: 2005-08-01
CID: 455652

2416. 16887-98-2; 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-dimorpholin-4-ylpyrimido[5,4-d]pyrimidin-6-yl]-(2-hydroxyethyl)amino]ethanol; NSC516403 ...
MW:     508.571240 g/mol MF: C22H36N8O6
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-dimorpholin-4-ylpyrimid...
Create Date: 2005-03-26
CID: 350854

2417. NSC372683; 2,2'-Dithiobis(5-methoxybenzoic acid); MLS003171303 ...
MW:     366.408760 g/mol MF: C16H14O6S2
IUPAC name: 2-[(2-carboxy-4-methoxyphenyl)disulfanyl]-5-methoxybenzoic a...
Create Date: 2005-03-26
CID: 341151

2418. NSC348702; AQUAYAMYCIN ANALOG; AC1L7IL7 ...
MW:     470.468540 g/mol MF: C25H26O9
IUPAC name: 4-[6-(4,5-dihydroxy-6-methyloxan-2-yl)-5-hydroxy-9,10-dioxoa...
Create Date: 2005-03-26
CID: 335958

2419. 86625-99-2; 2-[(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)methoxy]ethanol; 2-[(5-amino-2,4,9-triazabicyclo[4.3.0]nona-1,3,5,7-tetraen-9-yl)methoxy]ethanol ...
MW:     208.217180 g/mol MF: C9H12N4O2
IUPAC name: 2-[(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)methoxy]ethanol
Create Date: 2005-03-26
CID: 334340

2420. 2(1h)-quinolinone, 5,8-dimethoxy-4-methyl-; 5,8-Dimethoxy-4-methylquinolin-2(1H)-one; 23947-41-3 ...
MW:     219.236520 g/mol MF: C12H13NO3
IUPAC name: 5,8-dimethoxy-4-methyl-1H-quinolin-2-one
Create Date: 2005-03-26
CID: 269167

2421. 1,4-dimethylquinolin-2(1h)-one; 2584-47-6; 1,4-Dimethyl-2(1H)-quinolinone ...
MW:     173.211140 g/mol MF: C11H11NO
IUPAC name: 1,4-dimethylquinolin-2-one
Create Date: 2005-03-26
CID: 97252

2422. 3,3'-Dithiodipropionic acid; 1119-62-6; Dithiodipropionic acid ...
MW:     210.271200 g/mol MF: C6H10O4S2
IUPAC name: 3-(2-carboxyethyldisulfanyl)propanoic acid
Create Date: 2005-03-26
CID: 95116

2423. Phosphoric acid, diethyl p-(methylsulfonyl)phenyl ester; Diethyl 4-(methylsulfonyl)phenyl phosphate; Phosphoric acid, diethyl 4-(methylsulfonyl)phenyl ester ...
MW:     308.287842 g/mol MF: C11H17O6PS
IUPAC name: diethyl (4-methylsulfonylphenyl) phosphate
Create Date: 2005-03-27
CID: 80214

2424. 4'-Thiothymidine; Thymidine, 4'-thio-; BRN 4322066 ...
MW:     258.294160 g/mol MF: C10H14N2O4S
IUPAC name: 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)thiolan-2-yl]-5-met...
Create Date: 2005-08-01
CID: 72371

2425. rac-2-Ethoxy-3-octadecanamido-1-propylphosphocholine; NSC624874; 112989-02-3 ...
MW:     550.751622 g/mol MF: C28H59N2O6P
IUPAC name: [2-ethoxy-3-(octadecanoylamino)propyl] 2-(trimethylazaniumyl...
Create Date: 2005-03-26
CID: 72241

2426. 4-Methylquinolin-2-ol; 2-Hydroxy-4-methylquinoline; 607-66-9 ...
MW:     159.184560 g/mol MF: C10H9NO
IUPAC name: 4-methyl-1H-quinolin-2-one
Create Date: 2005-03-26
CID: 69088

2427. CGS-15943; Cgs 15943; 104615-18-1 ...
MW:     285.688520 g/mol MF: C13H8ClN5O
IUPAC name: 9-chloro-2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-a...
Create Date: 2005-03-25
CID: 2690

2428. Diazoketone methotrexate; AC1NUPP3; Methotrexate diazoketone analog ...
MW:     478.463980 g/mol MF: C21H22N10O4
IUPAC name: (Z,5S)-5-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]b...
Create Date: 2005-08-08
CID: 5487633

2429. UNII-Y0X1YWE4CK; Y0X1YWE4CK; Heptyl-UR-144 ...
MW:     339.514220 g/mol MF: C23H33NO
IUPAC name: (1-heptylindol-3-yl)-(2,2,3,3-tetramethylcyclopropyl)methano...
Create Date: 2016-03-16
CID: 118796527

2430. CHEMBL25110; Acylphosphoramidate analogue; BDBM50040468 ...
MW:     460.606160 g/mol MF: C25H34NO5S-
IUPAC name: (1E)-1-[2,6-di(propan-2-yl)phenoxy]-N-[2,6-di(propan-2-yl)ph...
Create Date: 2015-10-08
CID: 91929211

2431. pyrrolidinone analogue, 29; BDBM19812; [(2S)-1-{3-[(2S)-2-{[(benzyloxy)carbonyl]amino}-4-methylpentanamido]-4-oxopyrrolidin-1-yl}-4-methyl-1-oxopentan-2-yl](methyl)azanium chloride
MW:     475.600960 g/mol MF: C25H39N4O5+
IUPAC name: methyl-[(2S)-4-methyl-1-[3-[[(2S)-4-methyl-2-(phenylmethoxyc...
Create Date: 2015-10-06
CID: 91895928

2432. ABT-341 analogue 22; BDBM12655; (1S,6R)-3-[(3-carbamoylphenyl)carbamoyl]-6-(2,4,5-trifluorophenyl)cyclohex-3-en-1-aminium; 2,2,2-trifluoroacetate
MW:     390.378970 g/mol MF: C20H19F3N3O2+
IUPAC name: [(1S,6R)-3-[(3-carbamoylphenyl)carbamoyl]-6-(2,4,5-trifluoro...
Create Date: 2015-10-06
CID: 91895875

2433. ABT-341 analogue 17; BDBM12654; 3-{[trans-5-amino-4-(2,4,5-trifluorophenyl)cyclohex-1-en-1-yl]methoxy}benzamide ...
MW:     377.380210 g/mol MF: C20H20F3N2O2+
IUPAC name: [(1S,6R)-3-[(3-carbamoylphenoxy)methyl]-6-(2,4,5-trifluoroph...
Create Date: 2015-10-06
CID: 91895874

2434. ABT-341 analogue 19; BDBM12653; (1S,6R)-3-{[(3-carbamoylphenyl)amino]methyl}-6-(2,4,5-trifluorophenyl)cyclohex-3-en-1-aminium; 2,2,2-trifluoroacetate
MW:     376.395450 g/mol MF: C20H21F3N3O+
IUPAC name: [(1S,6R)-3-[(3-carbamoylanilino)methyl]-6-(2,4,5-trifluoroph...
Create Date: 2015-10-06
CID: 91895873

2435. ABT-341 analogue 14; BDBM12652; (1S,6R)-3-(1,2,3,4-tetrahydroisoquinolin-2-ylmethyl)-6-(2,4,5-trifluorophenyl)cyclohex-3-en-1-aminium; 2,2,2-trifluoroacetate
MW:     373.434570 g/mol MF: C22H24F3N2+
IUPAC name: [(1S,6R)-3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-6-(2,4,5-...
Create Date: 2015-10-06
CID: 91895872

2436. Crosemperine ethyl analogue; JSRISOTXWALVLP-KYLTXLLZSA-N
MW:     353.410080 g/mol MF: C18H27NO6
IUPAC name: (1R,10Z)-4-ethyl-6-hydroxy-5,6,13-trimethyl-2,8-dioxa-13-aza...
Create Date: 2015-04-28
CID: 91753268

2437. Dursbanoxon-d10; Chlorpyriphoxon-d10; Chlorpyrifos Oxon-d10 ...
MW:     344.582320 g/mol MF: C9H11Cl3NO4P
IUPAC name: bis(1,1,2,2,2-pentadeuterioethyl) (3,5,6-trichloropyridin-2-...
Create Date: 2013-05-17
CID: 71314845

2438. Phthalonitrile analogue, 4i; BDBM86780
MW:     327.175340 g/mol MF: C16H11BrN2O
IUPAC name: 4-[2-(4-bromophenyl)ethoxy]benzene-1,2-dicarbonitrile
Create Date: 2012-07-07
CID: 57340732

2439. Phthalonitrile analogue, 4d; BDBM86775
MW:     262.305860 g/mol MF: C17H14N2O
IUPAC name: 4-(3-phenylpropoxy)benzene-1,2-dicarbonitrile
Create Date: 2012-07-07
CID: 57340729

2440. Phthalonitrile analogue, 4c; BDBM86774
MW:     248.279280 g/mol MF: C16H12N2O
IUPAC name: 4-(2-phenylethoxy)benzene-1,2-dicarbonitrile
Create Date: 2012-07-07
CID: 57340728

2441. GlcNAc-Asn analogue, 12; BDBM85476
MW:     341.155780 g/mol MF: C10H17BrN2O6
IUPAC name: N-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]-2-b...
Create Date: 2012-07-07
CID: 57340135

2442. GlcNAc-Asn analogue, 11; BDBM85475
MW:     296.704780 g/mol MF: C10H17ClN2O6
IUPAC name: N-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]-2-c...
Create Date: 2012-07-07
CID: 57340134

2443. Ethyl carbamate analog, 3; BDBM81914
MW:     386.424920 g/mol MF: C18H18N4O4S
IUPAC name: ethyl N-[[4-[(3Z)-3-(2-hydroxy-4-oxocyclohexa-2,5-dien-1-yli...
Create Date: 2011-12-15
CID: 54592347

2444. Rapamycin C-7, analog 9; BDBM36618
MW:    1050.319780 g/mol MF: C59H87NO15
Create Date: 2011-04-25
CID: 51049456

2445. V11294 Analogue 5s; BDBM14383; ZINC13609840 ...
MW:     530.594880 g/mol MF: C29H32N5O5-
IUPAC name: 4-[2-[6-amino-3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]pu...
Create Date: 2011-01-04
CID: 49827599

2446. CHEMBL422470; Lactum Sulfonamide analogue; BDBM50054495
MW:     472.602040 g/mol MF: C20H36N6O5S
IUPAC name: N-[(1S)-3-carbamimidoyl-2-hydroxycyclohexyl]-2-[(3S)-3-(cycl...
Create Date: 2009-11-19
CID: 44359805

2447. naphthyridinone analog.,21; CHEMBL447057; SCHEMBL3364094 ...
MW:     162.145440 g/mol MF: C8H6N2O2
IUPAC name: 1,5-dihydro-1,5-naphthyridine-2,3-dione
Create Date: 2009-08-24
CID: 44157571

2448. naphthyridinone analog.,20; CHEMBL510126; SCHEMBL3423734 ...
MW:     162.145440 g/mol MF: C8H6N2O2
IUPAC name: 1,7-dihydro-1,7-naphthyridine-2,3-dione
Create Date: 2009-08-24
CID: 44157414

2449. naphthyridinone analog.,19; CHEMBL468496; SCHEMBL3360519 ...
MW:     162.145440 g/mol MF: C8H6N2O2
IUPAC name: 3-hydroxy-1H-1,6-naphthyridin-2-one
Create Date: 2009-08-24
CID: 44157412

2450. benzimidazole analogue, 7q; CHEMBL467280; BDBM30018
MW:     475.049840 g/mol MF: C23H31ClN6OS
IUPAC name: 2-[4-[[6-chloro-5-(4-ethylpiperazin-1-yl)-1H-benzimidazol-2-...
Create Date: 2009-08-19
CID: 44143457

2451. benzimidazole analogue, 7p; CHEMBL467279; BDBM30017
MW:     461.023260 g/mol MF: C22H29ClN6OS
IUPAC name: 2-[4-[[6-chloro-5-(4-ethylpiperazin-1-yl)-1H-benzimidazol-2-...
Create Date: 2009-08-19
CID: 44143456

2452. benzimidazole analogue, 7o; CHEMBL466252; BDBM30016
MW:     475.049840 g/mol MF: C23H31ClN6OS
IUPAC name: 5-[4-[[6-chloro-5-(4-ethylpiperazin-1-yl)-1H-benzimidazol-2-...
Create Date: 2009-08-19
CID: 44143455

2453. benzimidazole analogue, 7n; CHEMBL511205; BDBM30015
MW:     475.053140 g/mol MF: C22H31ClN8S
IUPAC name: 6-chloro-5-(4-ethylpiperazin-1-yl)-2-[1-methyl-4-(1-methylte...
Create Date: 2009-08-19
CID: 44143454

2454. benzimidazole analogue, 7m; CHEMBL466448; BDBM30014
MW:     475.053140 g/mol MF: C22H31ClN8S
IUPAC name: 6-chloro-5-(4-ethylpiperazin-1-yl)-2-[1-methyl-4-(2-methylte...
Create Date: 2009-08-19
CID: 44143453

2455. benzimidazole analogue, 7l; CHEMBL468524; BDBM30013
MW:     471.079440 g/mol MF: C21H31ClN4O2S2
IUPAC name: 6-chloro-5-(4-ethylpiperazin-1-yl)-2-(1-methyl-4-methylsulfo...
Create Date: 2009-08-19
CID: 44143452

2456. benzimidazole analogue, 7k; CHEMBL468315; BDBM30012
MW:     450.040380 g/mol MF: C22H32ClN5OS
IUPAC name: 4-[[6-chloro-5-(4-ethylpiperazin-1-yl)-1H-benzimidazol-2-yl]...
Create Date: 2009-08-19
CID: 44143451

2457. benzimidazole analogue, 7j; CHEMBL506207; BDBM30011
MW:     476.077660 g/mol MF: C24H34ClN5OS
IUPAC name: 1-[4-[[6-chloro-5-(4-ethylpiperazin-1-yl)-1H-benzimidazol-2-...
Create Date: 2009-08-19
CID: 44143450

2458. benzimidazole analogue, 7i; CHEMBL467266; BDBM30010
MW:     486.094080 g/mol MF: C21H32ClN5O2S2
IUPAC name: N-[4-[[6-chloro-5-(4-ethylpiperazin-1-yl)-1H-benzimidazol-2-...
Create Date: 2009-08-19
CID: 44143449

2459. benzimidazole analogue, 7g; CHEMBL467677; BDBM30008
MW:     450.040380 g/mol MF: C22H32ClN5OS
IUPAC name: N-[4-[[6-chloro-5-(4-ethylpiperazin-1-yl)-1H-benzimidazol-2-...
Create Date: 2009-08-19
CID: 44143448

2460. benzimidazole analogue, 7f; BDBM30007
MW:     452.013200 g/mol MF: C21H30ClN5O2S
IUPAC name: methyl N-[(1S,3S)-3-[[6-chloro-5-(4-ethylpiperazin-1-yl)-1H-...
Create Date: 2009-08-19
CID: 44143447

2461. benzimidazole analogue, 7c; CHEMBL466222; BDBM30004
MW:     466.039780 g/mol MF: C22H32ClN5O2S
IUPAC name: ethyl 4-[[6-chloro-5-(4-ethylpiperazin-1-yl)-1H-benzimidazol...
Create Date: 2009-08-19
CID: 44143446

2462. benzimidazole analogue, 7b; CHEMBL466221; BDBM30003
MW:     440.002500 g/mol MF: C20H30ClN5O2S
IUPAC name: methyl N-[3-[[6-chloro-5-(4-ethylpiperazin-1-yl)-1H-benzimid...
Create Date: 2009-08-19
CID: 44143445

2463. benzimidazole analogue, 7a; CHEMBL466020; BDBM30002
MW:     352.925200 g/mol MF: C17H25ClN4S
IUPAC name: 2-tert-butylsulfanyl-6-chloro-5-(4-ethylpiperazin-1-yl)-1H-b...
Create Date: 2009-08-19
CID: 44143444

2464. benzimidazole analogue, 5f; BDBM30001
MW:     394.961880 g/mol MF: C19H27ClN4OS
IUPAC name: 1-[(3R)-4-(2-tert-butylsulfanyl-6-chloro-1H-benzimidazol-5-y...
Create Date: 2009-08-19
CID: 44143443

2465. benzimidazole analogue, 5e; CHEMBL466630; BDBM30000
MW:     391.961240 g/mol MF: C19H26ClN5S
IUPAC name: 3-[(3R)-4-(2-tert-butylsulfanyl-6-chloro-1H-benzimidazol-5-y...
Create Date: 2009-08-19
CID: 44143442

2466. benzimidazole analogue, 5d; CHEMBL466427; BDBM29999
MW:     377.934660 g/mol MF: C18H24ClN5S
IUPAC name: 2-[(3R)-4-(2-tert-butylsulfanyl-6-chloro-1H-benzimidazol-5-y...
Create Date: 2009-08-19
CID: 44143441

2467. benzimidazole analogue, 5c; CHEMBL467669; BDBM29998
MW:     420.923170 g/mol MF: C18H24ClF3N4S
IUPAC name: 2-tert-butylsulfanyl-6-chloro-5-[(2R)-2-methyl-4-(2,2,2-trif...
Create Date: 2009-08-19
CID: 44143440

2468. benzimidazole analogue, 5b; CHEMBL450887; BDBM29997
MW:     402.932706 g/mol MF: C18H25ClF2N4S
IUPAC name: 2-tert-butylsulfanyl-6-chloro-5-[(2R)-4-(2,2-difluoroethyl)-...
Create Date: 2009-08-19
CID: 44143439

2469. benzimidazole analogue, 5a; CHEMBL468504; BDBM29996
MW:     366.951780 g/mol MF: C18H27ClN4S
IUPAC name: 2-tert-butylsulfanyl-6-chloro-5-[(2R)-4-ethyl-2-methylpipera...
Create Date: 2009-08-19
CID: 44143438

2470. Frenolicin B analogue, 4; CHEMBL474391; BDBM29509
MW:     342.342620 g/mol MF: C19H18O6
Create Date: 2009-06-25
CID: 42618236

2471. phthalazinone analogue, 9b; SCHEMBL6368050; BDBM27717 ...
MW:     377.454563 g/mol MF: C23H24FN3O
IUPAC name: 4-[4-[4-(4-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]butyl]-...
Create Date: 2009-04-13
CID: 25218517

2472. CHEMBL363307; 19407-56-8; 5-Chloro-2-methyl-3H-quinazolin-4-one ...
MW:     194.617680 g/mol MF: C9H7ClN2O
IUPAC name: 5-chloro-2-methyl-1H-quinazolin-4-one
Create Date: 2009-04-13
CID: 25218515

2473. CHEMBL481511; quinazolinone analogue, 1c; BDBM27707 ...
MW:     404.892040 g/mol MF: C23H21ClN4O
IUPAC name: 4-[1-[3-(8-chloro-4-oxo-1H-quinazolin-2-yl)propyl]-3,6-dihyd...
Create Date: 2009-04-13
CID: 25218514

2474. benzimidazole analog., 31; CHEMBL253076; SCHEMBL6790435 ...
MW:     458.457866 g/mol MF: C23H24F2N4O4
IUPAC name: (3R,4R)-4-[[4-[[2-(1,1-difluoroethyl)benzimidazol-1-yl]methy...
Create Date: 2009-03-16
CID: 25190502

2475. benzimidazole analog., 30; CHEMBL253075; SCHEMBL6790832 ...
MW:     454.493983 g/mol MF: C24H27FN4O4
IUPAC name: (3R,4R)-4-[[4-[[2-(2-fluoropropan-2-yl)benzimidazol-1-yl]met...
Create Date: 2009-03-16
CID: 25190501

2476. benzooxazole analogue, 16b; CHEMBL462466; BDBM26726 ...
MW:     481.587120 g/mol MF: C24H23N3O4S2
IUPAC name: N-[4-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-1-thiophen-2-ylsu...
Create Date: 2009-03-16
CID: 25188505

2477. quinoxaline analogue, 16f; CHEMBL446296; BDBM26725 ...
MW:     478.586480 g/mol MF: C24H22N4O3S2
IUPAC name: N-(4-quinoxalin-2-ylphenyl)-1-thiophen-2-ylsulfonylpiperidin...
Create Date: 2009-03-16
CID: 25187694

2478. benzyl amide analog., 13; CHEMBL269983; BDBM25992 ...
MW:     482.573500 g/mol MF: C29H30N4O3
IUPAC name: 4-[2-methyl-5-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-N-[[3-(...
Create Date: 2008-12-11
CID: 25093466

2479. aminothiazole analogue, 73; BDBM25724; 2-[(5-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}pyridin-2-yl)amino]-1,3-thiazole-5-carbonitrile
MW:     344.434600 g/mol MF: C16H20N6OS
IUPAC name: 2-[[5-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]pyridin-2-yl...
Create Date: 2008-12-11
CID: 25093346

2480. aminothiazole analogue, 72; BDBM25723; 2-({5-[(4-ethylpiperazin-1-yl)methyl]pyridin-2-yl}amino)-1,3-thiazole-5-carbonitrile
MW:     328.435200 g/mol MF: C16H20N6S
IUPAC name: 2-[[5-[(4-ethylpiperazin-1-yl)methyl]pyridin-2-yl]amino]-1,3...
Create Date: 2008-12-11
CID: 25093345

2481. aminothiazole analogue, 71; BDBM25722; 2-({5-[(4-methylpiperazin-1-yl)methyl]pyridin-2-yl}amino)-1,3-thiazole-5-carbonitrile
MW:     314.408620 g/mol MF: C15H18N6S
IUPAC name: 2-[[5-[(4-methylpiperazin-1-yl)methyl]pyridin-2-yl]amino]-1,...
Create Date: 2008-12-11
CID: 25093344

2482. aminothiazole analogue, 70; BDBM25721; 4-({6-[(5-cyano-1,3-thiazol-2-yl)amino]pyridin-3-yl}methyl)-N-methylpiperazine-1-carboxamide
MW:     357.433360 g/mol MF: C16H19N7OS
IUPAC name: 4-[[6-[(5-cyano-1,3-thiazol-2-yl)amino]pyridin-3-yl]methyl]-...
Create Date: 2008-12-11
CID: 25093343

2483. aminothiazole analogue, 69; BDBM25720; 2-{[5-(morpholin-4-ylmethyl)pyridin-2-yl]amino}-1,3-thiazole-5-carbonitrile
MW:     301.366800 g/mol MF: C14H15N5OS
IUPAC name: 2-[[5-(morpholin-4-ylmethyl)pyridin-2-yl]amino]-1,3-thiazole...
Create Date: 2008-12-11
CID: 25093342

2484. aminothiazole analogue, 58; SCHEMBL14066802; BDBM25714 ...
MW:     283.187440 g/mol MF: C11H11BrN2S
IUPAC name: 5-bromo-N-(2-phenylethyl)-1,3-thiazol-2-amine
Create Date: 2008-12-11
CID: 25093341

2485. aminothiazole analogue, 53; SCHEMBL14066799; BDBM25709 ...
MW:     391.130219 g/mol MF: C11H5BrF6N2S
IUPAC name: N-[3,5-bis(trifluoromethyl)phenyl]-5-bromo-1,3-thiazol-2-ami...
Create Date: 2008-12-11
CID: 25093340

2486. aminothiazole analogue, 52; SCHEMBL14066796; BDBM25708 ...
MW:     283.187440 g/mol MF: C11H11BrN2S
IUPAC name: 5-bromo-N-(3,5-dimethylphenyl)-1,3-thiazol-2-amine
Create Date: 2008-12-11
CID: 25093339

2487. aminothiazole analogue, 51; SCHEMBL14066797; BDBM25707 ...
MW:     324.024400 g/mol MF: C9H5BrCl2N2S
IUPAC name: 5-bromo-N-(3,5-dichlorophenyl)-1,3-thiazol-2-amine
Create Date: 2008-12-11
CID: 25093338

2488. aminothiazole analogue, 50; SCHEMBL14066795; BDBM25706 ...
MW:     324.024400 g/mol MF: C9H5BrCl2N2S
IUPAC name: 5-bromo-N-(3,4-dichlorophenyl)-1,3-thiazol-2-amine
Create Date: 2008-12-11
CID: 25093337

2489. aminothiazole analogue, 49; SCHEMBL14066793; BDBM25705 ...
MW:     291.115206 g/mol MF: C9H5BrF2N2S
IUPAC name: 5-bromo-N-(2,5-difluorophenyl)-1,3-thiazol-2-amine
Create Date: 2008-12-11
CID: 25093336

2490. aminothiazole analogue, 48; SCHEMBL14066789; BDBM25704 ...
MW:     291.115206 g/mol MF: C9H5BrF2N2S
IUPAC name: 5-bromo-N-(2,4-difluorophenyl)-1,3-thiazol-2-amine
Create Date: 2008-12-11
CID: 25093335

2491. aminothiazole analogue, 46; SCHEMBL14066786; BDBM25702 ...
MW:     323.132250 g/mol MF: C10H6BrF3N2S
IUPAC name: 5-bromo-N-[2-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine
Create Date: 2008-12-11
CID: 25093334

2492. aminothiazole analogue, 15; SCHEMBL14066778; BDBM25671 ...
MW:     339.131650 g/mol MF: C10H6BrF3N2OS
IUPAC name: 5-bromo-N-[4-(trifluoromethoxy)phenyl]-1,3-thiazol-2-amine
Create Date: 2008-12-11
CID: 25093333

2493. 4-Bromo-N-(4-fluorophenyl)thiazol-2-amine; 923947-59-5; aminothiazole analogue, 3b ...
MW:     273.124743 g/mol MF: C9H6BrFN2S
IUPAC name: 4-bromo-N-(4-fluorophenyl)-1,3-thiazol-2-amine
Create Date: 2008-12-11
CID: 25093330

2494. chelerythrine analogue, 44; CHEMBL1186432; BDBM25542 ...
MW:     270.303140 g/mol MF: C16H16NO3+
IUPAC name: 2-(2-hydroxyethyl)-5-methylphenanthridin-5-ium-7,8-diol
Create Date: 2008-12-11
CID: 25093292

2495. chelerythrine analogue, 43; CHEMBL1186435; BDBM25541 ...
MW:     256.276560 g/mol MF: C15H14NO3+
IUPAC name: 2-(hydroxymethyl)-5-methylphenanthridin-5-ium-7,8-diol
Create Date: 2008-12-11
CID: 25093290

2496. chelerythrine analogue, 42; CHEMBL1186349; BDBM25540 ...
MW:     226.250580 g/mol MF: C14H12NO2+
IUPAC name: 5-methylphenanthridin-5-ium-7,8-diol
Create Date: 2008-12-11
CID: 25093288

2497. sanguinarine analogue, 41; CHEMBL1186369; BDBM25539 ...
MW:     296.340420 g/mol MF: C18H18NO3+
IUPAC name: 8-(2-methoxyethyl)-5-methyl-[1,3]dioxolo[4,5-i]phenanthridin...
Create Date: 2008-12-11
CID: 25093286

2498. sanguinarine analogue, 40; CHEMBL1187612; BDBM25538 ...
MW:     282.313840 g/mol MF: C17H16NO3+
IUPAC name: 8-(methoxymethyl)-5-methyl-[1,3]dioxolo[4,5-i]phenanthridin-...
Create Date: 2008-12-11
CID: 25093284

2499. sanguinarine analogue, 35; CHEMBL1186356; BDBM25537 ...
MW:     282.313840 g/mol MF: C17H16NO3+
IUPAC name: 2-(5-methyl-[1,3]dioxolo[4,5-i]phenanthridin-5-ium-8-yl)etha...
Create Date: 2008-12-11
CID: 25093282

2500. sanguinarine analogue, 34; CHEMBL1186355; BDBM25536 ...
MW:     268.287260 g/mol MF: C16H14NO3+
IUPAC name: (5-methyl-[1,3]dioxolo[4,5-i]phenanthridin-5-ium-8-yl)methan...
Create Date: 2008-12-11
CID: 25093280

2501. chelerythrine analogue, 33; CHEMBL1187328; BDBM25535 ...
MW:     284.329720 g/mol MF: C17H18NO3+
IUPAC name: (7,8-dimethoxy-5-methylphenanthridin-5-ium-2-yl)methanol
Create Date: 2008-12-11
CID: 25093278

2502. sanguinarine analogue, 19; CHEMBL459760; BDBM25534 ...
MW:     267.279320 g/mol MF: C16H13NO3
IUPAC name: 2,2-dimethyl-5-oxido-[1,3]dioxolo[4,5-i]phenanthridin-5-ium
Create Date: 2008-12-11
CID: 25093276

2503. sanguinarine analogue, 18; CHEMBL461240; BDBM25533 ...
MW:     239.226160 g/mol MF: C14H9NO3
IUPAC name: 5-oxido-[1,3]dioxolo[4,5-i]phenanthridin-5-ium
Create Date: 2008-12-11
CID: 25093275

2504. chelerythrine analogue, 17; CHEMBL461025; BDBM25532 ...
MW:     255.268620 g/mol MF: C15H13NO3
IUPAC name: 7,8-dimethoxy-5-oxidophenanthridin-5-ium
Create Date: 2008-12-11
CID: 25093274

2505. sanguinarine analogue, 16; CHEMBL1186174; BDBM25531 ...
MW:     266.314440 g/mol MF: C17H16NO2+
IUPAC name: 2,2,5-trimethyl-[1,3]dioxolo[4,5-i]phenanthridin-5-ium
Create Date: 2008-12-11
CID: 25093273

2506. sanguinarine analogue, 15; CHEMBL1186111; BDBM25530 ...
MW:     238.261280 g/mol MF: C15H12NO2+
IUPAC name: 5-methyl-[1,3]dioxolo[4,5-i]phenanthridin-5-ium
Create Date: 2008-12-11
CID: 25093271

2507. chelerythrine analogue, 14; CHEMBL1186434; BDBM25529 ...
MW:     254.303740 g/mol MF: C16H16NO2+
IUPAC name: 7,8-dimethoxy-5-methylphenanthridin-5-ium
Create Date: 2008-12-11
CID: 25093269

2508. sanguinarine analogue, 13; CHEMBL455246; BDBM25528 ...
MW:     251.279920 g/mol MF: C16H13NO2
IUPAC name: 2,2-dimethyl-[1,3]dioxolo[4,5-i]phenanthridine
Create Date: 2008-12-11
CID: 25093267

2509. sanguinarine analogue, 12; CHEMBL503278; SCHEMBL1692303 ...
MW:     223.226760 g/mol MF: C14H9NO2
IUPAC name: [1,3]dioxolo[4,5-i]phenanthridine
Create Date: 2008-12-11
CID: 25093266

2510. 4-pyridone analogue, 43; CHEMBL503139; BDBM24454 ...
MW:     582.528750 g/mol MF: C32H21F3N4O4
IUPAC name: 1-(3-fluoro-4-methoxyphenyl)-5-(4-fluorophenyl)-N-[3-fluoro-...
Create Date: 2008-09-22
CID: 24901687

2511. 4-pyridone analogue, 42; CHEMBL503901; BDBM24453 ...
MW:     586.947830 g/mol MF: C31H18ClF3N4O3
IUPAC name: 1-(4-chloro-3-fluorophenyl)-5-(4-fluorophenyl)-N-[3-fluoro-4...
Create Date: 2008-09-22
CID: 24901686

2512. 4-pyridone analogue, 41; CHEMBL455386; BDBM24452 ...
MW:     498.480206 g/mol MF: C28H20F2N4O3
IUPAC name: 1-cyclopropyl-5-(4-fluorophenyl)-N-[3-fluoro-4-(1H-pyrrolo[2...
Create Date: 2008-09-22
CID: 24901685

2513. 4-pyridone analogue, 37; CHEMBL508633; BDBM24451 ...
MW:     502.468906 g/mol MF: C27H20F2N4O4
IUPAC name: 5-(4-fluorophenyl)-N-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4...
Create Date: 2008-09-22
CID: 24901684

2514. 4-pyridone analogue, 34; CHEMBL454357; BDBM24450 ...
MW:     472.442926 g/mol MF: C26H18F2N4O3
IUPAC name: 5-(4-fluorophenyl)-N-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4...
Create Date: 2008-09-22
CID: 24901683

2515. 2-pyridone analogue, 20; CHEMBL452306; BDBM24448 ...
MW:     483.450623 g/mol MF: C26H18FN5O4
IUPAC name: 1-(4-carbamoylphenyl)-N-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridi...
Create Date: 2008-09-22
CID: 24901681

2516. 2-pyridone analogue, 15; CHEMBL508006; BDBM24443 ...
MW:     404.393783 g/mol MF: C22H17FN4O3
IUPAC name: 1-cyclopropyl-N-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-ylox...
Create Date: 2008-09-22
CID: 24901680

2517. 2-pyridone analogue, 14; CHEMBL507573; BDBM24442
MW:     420.436243 g/mol MF: C23H21FN4O3
IUPAC name: 1-tert-butyl-N-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy...
Create Date: 2008-09-22
CID: 24901679

2518. Tetraacetyldipyridamole; Dipyridamole Analogue, 75; CHEMBL388875 ...
MW:     672.772320 g/mol MF: C32H48N8O8
IUPAC name: 2-[2-acetyloxyethyl-[2-[bis(2-acetyloxyethyl)amino]-4,8-di(p...
Create Date: 2008-07-30
CID: 24860460

2519. Dipyridamole Analogue, 74; CHEMBL442098; BDBM23692 ...
MW:     616.666000 g/mol MF: C28H40N8O8
IUPAC name: 2-[[2-[bis(2-formyloxyethyl)amino]-4,8-di(piperidin-1-yl)pyr...
Create Date: 2008-07-30
CID: 24860459

2520. Dipyridamole Analogue, 59; BDBM23677; 2-({4,8-bis[(2,2-dimethylpropyl)amino]-6-[(2-hydroxyethyl)amino]pyrimido[5,4-d][1,3]diazin-2-yl}amino)ethan-1-ol
MW:     420.552240 g/mol MF: C20H36N8O2
IUPAC name: 2-[[4,8-bis(2,2-dimethylpropylamino)-2-(2-hydroxyethylamino)...
Create Date: 2008-07-30
CID: 24860458

2521. Dipyridamole Analogue, 58; BDBM23676; 2-({6-[bis(2-hydroxyethyl)amino]-4,8-bis[(2,2-dimethylpropyl)amino]pyrimido[5,4-d][1,3]diazin-2-yl}(2-hydroxyethyl)amino)ethan-1-ol
MW:     508.657360 g/mol MF: C24H44N8O4
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis(2,2-dimethylpropyla...
Create Date: 2008-07-30
CID: 24860457

2522. Dipyridamole Analogue, 20; CHEMBL242444; BDBM23638 ...
MW:     548.722760 g/mol MF: C30H44N8O2
Create Date: 2008-07-30
CID: 24860456

2523. Dipyridamole Analogue, 19; CHEMBL242008; BDBM23637 ...
MW:     636.827880 g/mol MF: C34H52N8O4
Create Date: 2008-07-30
CID: 24860455

2524. Dipyridamole Analogue, 18; CHEMBL430003; BDBM23636 ...
MW:     468.595040 g/mol MF: C24H36N8O2
IUPAC name: 2-[[4,8-bis(8-azabicyclo[3.2.1]octan-8-yl)-2-(2-hydroxyethyl...
Create Date: 2008-07-30
CID: 24860454

2525. Dipyridamole Analogue, 17; CHEMBL243524; BDBM23635 ...
MW:     556.700160 g/mol MF: C28H44N8O4
IUPAC name: 2-[[4,8-bis(8-azabicyclo[3.2.1]octan-8-yl)-2-[bis(2-hydroxye...
Create Date: 2008-07-30
CID: 24860453

2526. benzimidazole analogue, 18; CHEMBL406927; BDBM25147 ...
MW:     495.013040 g/mol MF: C27H31ClN4O3
IUPAC name: N-[(1S)-1-(6-chloro-1H-benzimidazol-2-yl)-7-oxooctyl]-2-(5-m...
Create Date: 2008-07-21
CID: 24853792

2527. 4-[(5-Bromo-1,3-Thiazol-2-Yl)amino]-N-Methylbenzamide; 2vgp; aminothiazole analogue, 25 ...
MW:     312.185600 g/mol MF: C11H10BrN3OS
IUPAC name: 4-[(5-bromo-1,3-thiazol-2-yl)amino]-N-methylbenzamide
Create Date: 2008-02-27
CID: 24180715

2528. methyl alcohol analogue,39; CHEMBL226098; SCHEMBL1124606 ...
MW:     512.521730 g/mol MF: C31H23F3N2O2
IUPAC name: [4-[3-[[4-(hydroxymethyl)phenyl]methylamino]phenyl]-8-(trifl...
Create Date: 2008-01-19
CID: 23648487

2529. chlamydocin-diol analog, 6; BDBM19160; (3S,9S,14aR)-9-benzyl-3-(6,7-dihydroxyheptyl)-6,6-dimethyl-tetradecahydropyrrolo[1,2-a][,,,]cyclododecane-1,4,7,10-tetrone
MW:     516.629700 g/mol MF: C27H40N4O6
IUPAC name: (3S,9S,12R)-3-benzyl-9-(6,7-dihydroxyheptyl)-6,6-dimethyl-1,...
Create Date: 2008-01-19
CID: 23648192

2530. FK228 Analogue, 15b; BDBM19155; (6R,9S,12R,16R)-16-[(1E)-4-(acetylsulfanyl)but-1-en-1-yl]-9,12-dimethyl-6-(propan-2-yl)-1-oxa-4,7,10,13-tetraazacyclohexadecane-2,5,8,11,14-pentone
MW:     498.592960 g/mol MF: C22H34N4O7S
IUPAC name: S-[(E)-4-[(6R,9S,12R,16S)-9,12-dimethyl-2,5,8,11,14-pentaoxo...
Create Date: 2008-01-19
CID: 23648187

2531. FK228 Analogue, 15a; BDBM19154; (6R,9R,12R,16R)-9,12-dimethyl-6-(propan-2-yl)-16-[(1E)-4-sulfanylbut-1-en-1-yl]-1-oxa-4,7,10,13-tetraazacyclohexadecane-2,5,8,11,14-pentone
MW:     456.556280 g/mol MF: C20H32N4O6S
IUPAC name: (6R,9R,12R,16R)-9,12-dimethyl-6-propan-2-yl-16-[(E)-4-sulfan...
Create Date: 2008-01-19
CID: 23648186

2532. CHEMBL420047; diaryl urea compound 6; BIRB-796 Analog 4 ...
MW:     398.500140 g/mol MF: C25H26N4O
IUPAC name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-naphthalen...
Create Date: 2008-01-19
CID: 23646852

2533. N-pyrazinylurea Analog 28; CHEMBL205951; BDBM14639 ...
MW:     297.268840 g/mol MF: C14H11N5O3
IUPAC name: 1-(5-cyanopyrazin-2-yl)-3-(4-formyl-2-methoxyphenyl)urea
Create Date: 2008-01-19
CID: 23646824

2534. N-pyrazinylurea Analog 25; CHEMBL205950; BDBM14638 ...
MW:     460.914000 g/mol MF: C21H25ClN6O4
IUPAC name: 1-[5-chloro-4-[2-(dimethylamino)ethoxy]-2-[(3-methyloxetan-3...
Create Date: 2008-01-19
CID: 23646823

2535. Kinome_2928; N-pyrazinylurea Analog 15; CHEMBL202635 ...
MW:     400.862040 g/mol MF: C19H21ClN6O2
IUPAC name: 1-[5-chloro-2-methoxy-4-(piperidin-1-ylmethyl)phenyl]-3-(5-c...
Create Date: 2008-01-19
CID: 23646814

2536. Kinome_2297; N-pyrazinylurea Analog 14; CHEMBL207995 ...
MW:     331.713900 g/mol MF: C14H10ClN5O3
IUPAC name: 1-(5-chloro-4-formyl-2-methoxyphenyl)-3-(5-cyanopyrazin-2-yl...
Create Date: 2008-01-19
CID: 23646813

2537. N-pyrazinylurea Analog 8v; CHEMBL205088; BDBM14627 ...
MW:     480.903640 g/mol MF: C23H21ClN6O4
IUPAC name: N-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methox...
Create Date: 2008-01-19
CID: 23646812

2538. N-pyrazinylurea Analog 8u; CHEMBL206460; BDBM14626 ...
MW:     514.941460 g/mol MF: C22H19ClN6O5S
IUPAC name: N-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methox...
Create Date: 2008-01-19
CID: 23646811

2539. N-pyrazinylurea Analog 8t; CHEMBL206558; BDBM14625 ...
MW:     466.877060 g/mol MF: C22H19ClN6O4
IUPAC name: N-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methox...
Create Date: 2008-01-19
CID: 23646810

2540. N-pyrazinylurea Analog 8s; CHEMBL381527; BDBM14624 ...
MW:     480.903640 g/mol MF: C23H21ClN6O4
IUPAC name: N-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methox...
Create Date: 2008-01-19
CID: 23646809

2541. N-pyrazinylurea Analog 8r; CHEMBL206143; BDBM14623 ...
MW:     480.903640 g/mol MF: C23H21ClN6O4
IUPAC name: N-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methox...
Create Date: 2008-01-19
CID: 23646808

2542. N-pyrazinylurea Analog 8q; CHEMBL378800; BDBM14622 ...
MW:     492.957400 g/mol MF: C25H25ClN6O3
IUPAC name: N-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methox...
Create Date: 2008-01-19
CID: 23646807

2543. N-pyrazinylurea Analog 8p; CHEMBL207582; BDBM14621 ...
MW:     464.904240 g/mol MF: C23H21ClN6O3
IUPAC name: N-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methox...
Create Date: 2008-01-19
CID: 23646806

2544. N-pyrazinylurea Analog 8o; CHEMBL210516; BDBM14620 ...
MW:     450.877660 g/mol MF: C22H19ClN6O3
IUPAC name: N-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methox...
Create Date: 2008-01-19
CID: 23646805

2545. N-pyrazinylurea Analog 8n; CHEMBL202838; BDBM14619 ...
MW:     470.931960 g/mol MF: C21H19ClN6O3S
IUPAC name: N-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methox...
Create Date: 2008-01-19
CID: 23646804

2546. N-pyrazinylurea Analog 8m; CHEMBL202837; BDBM14618 ...
MW:     442.878800 g/mol MF: C19H15ClN6O3S
IUPAC name: N-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methox...
Create Date: 2008-01-19
CID: 23646803

2547. N-pyrazinylurea Analog 8l; CHEMBL205491; BDBM14617 ...
MW:     428.852220 g/mol MF: C18H13ClN6O3S
IUPAC name: N-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methox...
Create Date: 2008-01-19
CID: 23646802

2548. N-pyrazinylurea Analog 8k; CHEMBL205754; BDBM14616 ...
MW:     412.786620 g/mol MF: C18H13ClN6O4
IUPAC name: N-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methox...
Create Date: 2008-01-19
CID: 23646801

2549. N-pyrazinylurea Analog 8j; CHEMBL379095; BDBM14615 ...
MW:     437.839140 g/mol MF: C20H16ClN7O3
IUPAC name: N-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methox...
Create Date: 2008-01-19
CID: 23646800

2550. N-pyrazinylurea Analog 8h; CHEMBL379458; BDBM14613 ...
MW:     423.812560 g/mol MF: C19H14ClN7O3
IUPAC name: N-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methox...
Create Date: 2008-01-19
CID: 23646799

2551. N-pyrazinylurea Analog 8g; CHEMBL425593; BDBM14612 ...
MW:     423.812560 g/mol MF: C19H14ClN7O3
IUPAC name: N-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methox...
Create Date: 2008-01-19
CID: 23646798

2552. N-pyrazinylurea Analog 8f; CHEMBL206997; BDBM14611 ...
MW:     488.924100 g/mol MF: C22H25ClN6O5
IUPAC name: methyl 8-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5...
Create Date: 2008-01-19
CID: 23646797

2553. N-pyrazinylurea Analog 8e; CHEMBL206098; BDBM14610 ...
MW:     432.817780 g/mol MF: C18H17ClN6O5
IUPAC name: methyl 4-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5...
Create Date: 2008-01-19
CID: 23646796

2554. N-pyrazinylurea Analog 8d; CHEMBL207606; BDBM14609 ...
MW:     418.791200 g/mol MF: C17H15ClN6O5
IUPAC name: [2-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-metho...
Create Date: 2008-01-19
CID: 23646795

2555. N-pyrazinylurea Analog 8c; CHEMBL207060; BDBM14608 ...
MW:     434.833660 g/mol MF: C18H19ClN6O5
IUPAC name: N-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methox...
Create Date: 2008-01-19
CID: 23646794

2556. N-pyrazinylurea Analog 8b; CHEMBL206213; BDBM14607 ...
MW:     418.834260 g/mol MF: C18H19ClN6O4
IUPAC name: N-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methox...
Create Date: 2008-01-19
CID: 23646793

2557. N-pyrazinylurea Analog 8a; CHEMBL381517; BDBM14606 ...
MW:     403.822920 g/mol MF: C17H18ClN7O3
IUPAC name: N-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methox...
Create Date: 2008-01-19
CID: 23646792

2558. benzimidazolone analog 13c; CHEMBL197255; BDBM14429 ...
MW:     483.948880 g/mol MF: C27H22ClN5O2
IUPAC name: 4-[[3-[(3-chlorophenyl)methyl]-1-methyl-2-oxobenzimidazol-5-...
Create Date: 2008-01-19
CID: 23646758

2559. benzimidazolone analog 13b; CHEMBL373093; BDBM14428 ...
MW:     584.835950 g/mol MF: C26H22ClIN4O2
IUPAC name: 3-[(3-chlorophenyl)methyl]-5-[hydroxy-(4-iodophenyl)-(3-meth...
Create Date: 2008-01-19
CID: 23646757

2560. benzimidazolone analog 13a; CHEMBL372000; BDBM14427 ...
MW:     493.384480 g/mol MF: C26H22Cl2N4O2
IUPAC name: 5-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-3...
Create Date: 2008-01-19
CID: 23646756

2561. V11294 Analogue 8c; BDBM14389; 3-(3-Cyclopentyloxy-4-methoxy-benzyl)-8-[1-(4-fluoro-benzyloxy)-ethyl]-3H-purin-6-ylamine ...
MW:     491.557203 g/mol MF: C27H30FN5O3
IUPAC name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[1-[(4-fluoro...
Create Date: 2008-01-19
CID: 23646747

2562. V11294 Analogue 8b; BDBM14388; 3-(3-Cyclopentyloxy-4-methoxy-benzyl)-8-[1-(4-methoxy-benzyloxy)-ethyl]-3H-purin-6-ylamine ...
MW:     503.592720 g/mol MF: C28H33N5O4
IUPAC name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[1-[(4-methox...
Create Date: 2008-01-19
CID: 23646746

2563. V11294 Analogue 5u; BDBM14385; 3-(3-Cyclopentyloxy-4-methoxy-benzyl)-8-[1,1-dimethyl-2-(thiophen-2-yloxy)-ethyl]-3H-purin-6-ylamine ...
MW:     493.621040 g/mol MF: C26H31N5O3S
IUPAC name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-(2-methyl-1-t...
Create Date: 2008-01-19
CID: 23646745

2564. V11294 Analogue 5l; SCHEMBL7742175; BDBM14376 ...
MW:     531.602820 g/mol MF: C29H33N5O5
IUPAC name: 8-[2-(1,3-benzodioxol-5-ylmethoxy)propan-2-yl]-3-[(3-cyclope...
Create Date: 2008-01-19
CID: 23646743

2565. V11294 Analogue 5g; SCHEMBL7738942; BDBM14371 ...
MW:     505.583783 g/mol MF: C28H32FN5O3
IUPAC name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[2-[(2-fluoro...
Create Date: 2008-01-19
CID: 23646741

2566. Fluoro-Olefin Analogue 21; CHEMBL175988; BDBM12439 ...
MW:     228.349403 g/mol MF: C13H25FN2
IUPAC name: N-(2-cyclohexylidene-2-fluoroethyl)-N',N'-dimethylpropane-1,...
Create Date: 2008-01-19
CID: 23646100

2567. Fluoro-Olefin Analogue 20; BDBM12438; 9.8l ...
MW:     360.465563 g/mol MF: C21H29FN2O2
IUPAC name: benzyl 4-[(2-cyclohexylidene-2-fluoroethyl)amino]piperidine-...
Create Date: 2008-01-19
CID: 23646099

2568. Fluoro-Olefin Analogue 19; CHEMBL366345; BDBM12437 ...
MW:     316.456063 g/mol MF: C20H29FN2
IUPAC name: 1-benzyl-N-(2-cyclohexylidene-2-fluoroethyl)piperidin-4-amin...
Create Date: 2008-01-19
CID: 23646098

2569. Fluoro-Olefin Analogue 18; CHEMBL176944; BDBM12436 ...
MW:     226.333523 g/mol MF: C13H23FN2
IUPAC name: N-(2-cyclohexylidene-2-fluoroethyl)piperidin-4-amine
Create Date: 2008-01-19
CID: 23646097

2570. Fluoro-Olefin Analogue 17; CHEMBL175900; BDBM12435 ...
MW:     247.350983 g/mol MF: C16H22FN
IUPAC name: 2-cyclohexylidene-2-fluoro-N-(2-phenylethyl)ethanamine
Create Date: 2008-01-19
CID: 23646096

2571. Fluoro-Olefin Analogue 16; CHEMBL179423; BDBM12434 ...
MW:     301.322373 g/mol MF: C16H19F4N
IUPAC name: 2-cyclohexylidene-2-fluoro-N-[[3-(trifluoromethyl)phenyl]met...
Create Date: 2008-01-19
CID: 23646095

2572. Fluoro-Olefin Analogue 15; CHEMBL361154; BDBM12433 ...
MW:     251.314866 g/mol MF: C15H19F2N
IUPAC name: 2-cyclohexylidene-2-fluoro-N-[(4-fluorophenyl)methyl]ethanam...
Create Date: 2008-01-19
CID: 23646094

2573. Fluoro-Olefin Analogue 14; CHEMBL179382; BDBM12432 ...
MW:     277.333903 g/mol MF: C16H20FNO2
IUPAC name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyclohexylidene-2-fluoroeth...
Create Date: 2008-01-19
CID: 23646093

2574. Fluoro-Olefin Analogue 13; CHEMBL180424; BDBM12431 ...
MW:     263.350383 g/mol MF: C16H22FNO
IUPAC name: 2-cyclohexylidene-2-fluoro-N-[(4-methoxyphenyl)methyl]ethana...
Create Date: 2008-01-19
CID: 23646092

2575. Fluoro-Olefin Analogue 12; CHEMBL176211; BDBM12430 ...
MW:     233.324403 g/mol MF: C15H20FN
IUPAC name: N-benzyl-2-cyclohexylidene-2-fluoroethanamine
Create Date: 2008-01-19
CID: 23646091

2576. Fluoro-Olefin Analogue 11; CHEMBL175442; BDBM12429 ...
MW:     219.297823 g/mol MF: C14H18FN
IUPAC name: N-(2-cyclohexylidene-2-fluoroethyl)aniline
Create Date: 2008-01-19
CID: 23646090

2577. Fluoro-Olefin Analogue 10; CHEMBL178975; BDBM12428 ...
MW:     277.420023 g/mol MF: C18H28FN
IUPAC name: N-(2-cyclohexylidene-2-fluoroethyl)adamantan-1-amine
Create Date: 2008-01-19
CID: 23646089

2578. Fluoro-Olefin Analogue 9; CHEMBL275472; BDBM12427 ...
MW:     225.345463 g/mol MF: C14H24FN
IUPAC name: N-(2-cyclohexylidene-2-fluoroethyl)cyclohexanamine
Create Date: 2008-01-19
CID: 23646088

2579. Fluoro-Olefin Analogue 8; CHEMBL179028; BDBM12426 ...
MW:     214.322823 g/mol MF: C12H23FN2
IUPAC name: N-(2-cyclopentylidene-2-fluoroethyl)-N',N'-dimethylpropane-1...
Create Date: 2008-01-19
CID: 23646087

2580. Fluoro-Olefin Analogue 7; CHEMBL359843; BDBM12425 ...
MW:     302.429483 g/mol MF: C19H27FN2
IUPAC name: 1-benzyl-N-(2-cyclopentylidene-2-fluoroethyl)piperidin-4-ami...
Create Date: 2008-01-19
CID: 23646086

2581. Fluoro-Olefin Analogue 6; CHEMBL176096; BDBM12424 ...
MW:     233.324403 g/mol MF: C15H20FN
IUPAC name: 2-cyclopentylidene-2-fluoro-N-(2-phenylethyl)ethanamine
Create Date: 2008-01-19
CID: 23646085

2582. Fluoro-Olefin Analogue 5; CHEMBL176138; BDBM12423 ...
MW:     234.312463 g/mol MF: C14H19FN2
IUPAC name: 2-cyclopentylidene-2-fluoro-N-(2-pyridin-2-ylethyl)ethanamin...
Create Date: 2008-01-19
CID: 23646084

2583. Fluoro-Olefin Analogue 4; CHEMBL179248; BDBM12422 ...
MW:     237.288286 g/mol MF: C14H17F2N
IUPAC name: 2-cyclopentylidene-2-fluoro-N-[(4-fluorophenyl)methyl]ethana...
Create Date: 2008-01-19
CID: 23646083

2584. Fluoro-Olefin Analogue 3; CHEMBL368716; BDBM12421 ...
MW:     249.323803 g/mol MF: C15H20FNO
IUPAC name: 2-cyclopentylidene-2-fluoro-N-[(4-methoxyphenyl)methyl]ethan...
Create Date: 2008-01-19
CID: 23646082

2585. Fluoro-Olefin Analogue 2; CHEMBL367660; BDBM12420 ...
MW:     219.297823 g/mol MF: C14H18FN
IUPAC name: N-benzyl-2-cyclopentylidene-2-fluoroethanamine
Create Date: 2008-01-19
CID: 23646081

2586. Fluoro-Olefin Analogue 1; CHEMBL177180; BDBM12419 ...
MW:     211.318883 g/mol MF: C13H22FN
IUPAC name: N-(2-cyclopentylidene-2-fluoroethyl)cyclohexanamine
Create Date: 2008-01-19
CID: 23646080

2587. AZD0530 analogue 36; CHEMBL216369; BDBM12258 ...
MW:     456.922000 g/mol MF: C23H25ClN4O4
IUPAC name: N-(5-chloro-1,3-benzodioxol-4-yl)-5-methoxy-7-(3-pyrrolidin-...
Create Date: 2008-01-19
CID: 23646040

2588. AZD0530 analogue 22; CHEMBL216586; BDBM12244 ...
MW:     345.780240 g/mol MF: C17H16ClN3O3
IUPAC name: N-(2-chloro-5-methoxyphenyl)-6,7-dimethoxyquinazolin-4-amine
Create Date: 2008-01-19
CID: 23646038

2589. arylsulfonamide analogue 18; BDBM12054; (S)-3-(3-Acetylamino-biphenyl-2-sulfonylamino)-4-oxo-butyric acid ...
MW:     390.410320 g/mol MF: C18H18N2O6S
IUPAC name: (3S)-3-[[2-(3-acetamidophenyl)phenyl]sulfonylamino]-4-oxobut...
Create Date: 2008-01-19
CID: 23645968

2590. arylsulfonamide analogue 17; BDBM12053; (S)-3-(2-Naphthalen-1-yl-benzenesulfonylamino)-4-oxo-butyric acid ...
MW:     383.417680 g/mol MF: C20H17NO5S
IUPAC name: (3S)-3-[(2-naphthalen-1-ylphenyl)sulfonylamino]-4-oxobutanoi...
Create Date: 2008-01-19
CID: 23645967

2591. arylsulfonamide analogue 15; BDBM12051; (S)-3-(3-Methyl-biphenyl-2-sulfonylamino)-4-oxo-butyric acid ...
MW:     347.385580 g/mol MF: C17H17NO5S
IUPAC name: (3S)-3-[[2-(3-methylphenyl)phenyl]sulfonylamino]-4-oxobutano...
Create Date: 2008-01-19
CID: 23645966

2592. arylsulfonamide analogue 14; BDBM12050; (S)-3-(2-Methyl-biphenyl-2-sulfonylamino)-4-oxo-butyric acid ...
MW:     347.385580 g/mol MF: C17H17NO5S
IUPAC name: (3S)-3-[[2-(2-methylphenyl)phenyl]sulfonylamino]-4-oxobutano...
Create Date: 2008-01-19
CID: 23645965

2593. arylsulfonamide analogue 13; BDBM12049; (S)-3-(6-Methyl-biphenyl-2-sulfonylamino)-4-oxo-butyric acid ...
MW:     347.385580 g/mol MF: C17H17NO5S
IUPAC name: (3S)-3-[(3-methyl-2-phenylphenyl)sulfonylamino]-4-oxobutanoi...
Create Date: 2008-01-19
CID: 23645964

2594. arylsulfonamide analogue 10; BDBM12046; (3S)-3-benzenesulfonamido-4-oxo-5-[(3-phenylpropyl)sulfanyl]pentanoic acid ...
MW:     421.530320 g/mol MF: C20H23NO5S2
IUPAC name: (3S)-3-(benzenesulfonamido)-4-oxo-5-(3-phenylpropylsulfanyl)...
Create Date: 2008-01-19
CID: 23645963

2595. CHEMBL190099; azole isoflavone analog 3a; BDBM9895 ...
MW:     319.314120 g/mol MF: C18H13N3O3
IUPAC name: 7-methoxy-3-phenyl-2-(1,2,4-triazol-1-yl)chromen-4-one
Create Date: 2008-01-19
CID: 23644935

2596. CHEMBL189274; azole isoflavone analog 2d; BDBM9894 ...
MW:     424.448000 g/mol MF: C26H20N2O4
IUPAC name: 2-imidazol-1-yl-3-(4-methoxyphenyl)-7-phenylmethoxychromen-4...
Create Date: 2008-01-19
CID: 23644934

2597. CHEMBL363493; azole isoflavone analog 2c; BDBM9893 ...
MW:     394.422020 g/mol MF: C25H18N2O3
IUPAC name: 2-imidazol-1-yl-3-phenyl-7-phenylmethoxychromen-4-one
Create Date: 2008-01-19
CID: 23644933

2598. CHEMBL189472; azole isoflavone analog 2b; BDBM9892 ...
MW:     348.352040 g/mol MF: C20H16N2O4
IUPAC name: 2-imidazol-1-yl-7-methoxy-3-(4-methoxyphenyl)chromen-4-one
Create Date: 2008-01-19
CID: 23644932

2599. P3 benzofuran analog 10; BDBM9160; CHEMBL321260 ...
MW:     730.172970 g/mol MF: C36H39ClF3N5O6
IUPAC name: (2S)-4-[(7-chloro-1-benzofuran-2-yl)methyl]-1-[(2S,4R)-2-hyd...
Create Date: 2008-01-19
CID: 23644799

2600. tacrine-E2020 analog 7; BDBM8983; CHEMBL185252 ...
MW:     478.627860 g/mol MF: C31H34N4O
IUPAC name: N-[2-(1-benzylpiperidin-4-yl)ethyl]-2-(5,10-dihydroindeno[1,...
Create Date: 2008-01-19
CID: 23644772

2601. tacrine-E2020 analog 6; BDBM8982; CHEMBL185254 ...
MW:     391.549020 g/mol MF: C25H33N3O
IUPAC name: N-[2-(1-benzylpiperidin-4-yl)ethyl]-2-(2,3-dihydro-1H-inden-...
Create Date: 2008-01-19
CID: 23644771

2602. tacrine-E2020 analog 5; BDBM8981; CHEMBL181816 ...
MW:     439.547220 g/mol MF: C25H33N3O4
IUPAC name: N-[2-[2-(1-benzylpiperidin-4-yl)ethylamino]-2-oxoethyl]-3,4-...
Create Date: 2008-01-19
CID: 23644770

2603. tacrine-E2020 analog 4; BDBM8980; N-[(1-benzylpiperidin-4-yl)methyl]-2-(1,2,3,4-tetrahydroacridin-9-ylamino)acetamide
MW:     442.595760 g/mol MF: C28H34N4O
IUPAC name: N-[(1-benzylpiperidin-4-yl)methyl]-2-(1,2,3,4-tetrahydroacri...
Create Date: 2008-01-19
CID: 23644769

2604. CHEMBL192306; azole isoflavone analog 2a; BDBM9891 ...
MW:     318.326060 g/mol MF: C19H14N2O3
IUPAC name: 2-imidazol-1-yl-7-methoxy-3-phenylchromen-4-one
Create Date: 2008-01-19
CID: 23644623

2605. 4-(4-BROMOPHENOXY)BENZONITRILE; 330792-93-3; Benzonitrile analogue, 5e ...
MW:     274.112720 g/mol MF: C13H8BrNO
IUPAC name: 4-(4-bromophenoxy)benzonitrile
Create Date: 2007-12-05
CID: 22347396

2606. GlcNAc-Asn analogue, 10; BDBM85474
MW:     277.274360 g/mol MF: C10H19N3O6
IUPAC name: N-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]-2-a...
Create Date: 2007-12-05
CID: 22297401

2607. 2-pyridone analogue, 19; CHEMBL510316; SCHEMBL4815343 ...
MW:     441.413943 g/mol MF: C24H16FN5O3
IUPAC name: N-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]-2-ox...
Create Date: 2007-12-05
CID: 21081772

2608. 2-pyridone analogue, 18; CHEMBL454101; SCHEMBL4817942 ...
MW:     441.413943 g/mol MF: C24H16FN5O3
IUPAC name: N-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]-2-ox...
Create Date: 2007-12-05
CID: 21081771

2609. 2-pyridone analogue, 13; CHEMBL451809; SCHEMBL4821129 ...
MW:     440.425883 g/mol MF: C25H17FN4O3
IUPAC name: N-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]-2-ox...
Create Date: 2007-12-05
CID: 21081770

2610. 2-pyridone analogue, 16; CHEMBL453849; SCHEMBL4818193 ...
MW:     434.462823 g/mol MF: C24H23FN4O3
IUPAC name: N-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]-1-(3...
Create Date: 2007-12-05
CID: 21081766

2611. 2-pyridone analogue, 17; CHEMBL453850; SCHEMBL4821654 ...
MW:     472.442926 g/mol MF: C26H18F2N4O3
IUPAC name: 1-[(4-fluorophenyl)methyl]-N-[3-fluoro-4-(1H-pyrrolo[2,3-b]p...
Create Date: 2007-12-05
CID: 21081760

2612. 3-hydroxy-1,8-naphthyridin-2(1H)-one hydrobromide; naphthyridinone analog.,18; CHEMBL468495 ...
MW:     162.145440 g/mol MF: C8H6N2O2
IUPAC name: 3-hydroxy-1H-1,8-naphthyridin-2-one
Create Date: 2007-12-05
CID: 20317991

2613. Dipyridamole Analogue, 49; CHEMBL395528; BDBM23667 ...
MW:     392.499080 g/mol MF: C18H32N8O2
IUPAC name: 2-[[4,8-bis(butylamino)-2-(2-hydroxyethylamino)pyrimido[5,4-...
Create Date: 2007-11-05
CID: 16757482

2614. Dipyridamole Analogue, 48; CHEMBL242893; BDBM23666 ...
MW:     480.604200 g/mol MF: C22H40N8O4
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis(butylamino)pyrimido...
Create Date: 2007-11-05
CID: 16757481

2615. Dipyridamole Analogue, 47; CHEMBL397454; BDBM23665 ...
MW:     364.445920 g/mol MF: C16H28N8O2
IUPAC name: 2-[[2-(2-hydroxyethylamino)-4,8-bis(propan-2-ylamino)pyrimid...
Create Date: 2007-11-05
CID: 16757480

2616. Dipyridamole Analogue, 46; CHEMBL242890; BDBM23664 ...
MW:     452.551040 g/mol MF: C20H36N8O4
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis(propan-2-ylamino)py...
Create Date: 2007-11-05
CID: 16757479

2617. Dipyridamole Analogue, 45; CHEMBL242680; BDBM23663 ...
MW:     364.445920 g/mol MF: C16H28N8O2
IUPAC name: 2-[[2-(2-hydroxyethylamino)-4,8-bis(propylamino)pyrimido[5,4...
Create Date: 2007-11-05
CID: 16757478

2618. Dipyridamole Analogue, 44; CHEMBL397453; BDBM23662 ...
MW:     452.551040 g/mol MF: C20H36N8O4
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis(propylamino)pyrimid...
Create Date: 2007-11-05
CID: 16757477

2619. Dipyridamole Analogue, 43; CHEMBL242677; BDBM23661 ...
MW:     336.392760 g/mol MF: C14H24N8O2
IUPAC name: 2-[[4,8-bis(ethylamino)-2-(2-hydroxyethylamino)pyrimido[5,4-...
Create Date: 2007-11-05
CID: 16757374

2620. Dipyridamole Analogue, 42; CHEMBL242465; BDBM23660 ...
MW:     424.497880 g/mol MF: C18H32N8O4
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis(ethylamino)pyrimido...
Create Date: 2007-11-05
CID: 16757373

2621. Dipyridamole Analogue, 41; CHEMBL395740; BDBM23659 ...
MW:     308.339600 g/mol MF: C12H20N8O2
IUPAC name: 2-[[2-(2-hydroxyethylamino)-4,8-bis(methylamino)pyrimido[5,4...
Create Date: 2007-11-05
CID: 16757372

2622. Dipyridamole Analogue, 37; CHEMBL387999; BDBM23655 ...
MW:     728.881720 g/mol MF: C42H48N8O4
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis(dibenzylamino)pyrim...
Create Date: 2007-11-05
CID: 16757371

2623. Dipyridamole Analogue, 35; CHEMBL242227; BDBM23653 ...
MW:     600.708120 g/mol MF: C26H48N8O8
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis[bis(2-methoxyethyl)...
Create Date: 2007-11-05
CID: 16757370

2624. Dipyridamole Analogue, 33; CHEMBL397280; BDBM23651 ...
MW:     648.923160 g/mol MF: C34H64N8O4
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis[bis(3-methylbutyl)a...
Create Date: 2007-11-05
CID: 16757267

2625. Dipyridamole Analogue, 32; CHEMBL389528; BDBM23650 ...
MW:     560.818040 g/mol MF: C30H56N8O2
IUPAC name: 2-[[4,8-bis(dipentylamino)-2-(2-hydroxyethylamino)pyrimido[5...
Create Date: 2007-11-05
CID: 16757266

2626. Dipyridamole Analogue, 30; CHEMBL444103; BDBM23648 ...
MW:     504.711720 g/mol MF: C26H48N8O2
IUPAC name: 2-[[4,8-bis[bis(2-methylpropyl)amino]-2-(2-hydroxyethylamino...
Create Date: 2007-11-05
CID: 16757265

2627. Dipyridamole Analogue, 28; CHEMBL396966; BDBM23646 ...
MW:     504.711720 g/mol MF: C26H48N8O2
IUPAC name: 2-[[4,8-bis(dibutylamino)-2-(2-hydroxyethylamino)pyrimido[5,...
Create Date: 2007-11-05
CID: 16757264

2628. Dipyridamole Analogue, 26; CHEMBL245244; BDBM23644 ...
MW:     448.605400 g/mol MF: C22H40N8O2
IUPAC name: 2-[[4,8-bis(dipropylamino)-2-(2-hydroxyethylamino)pyrimido[5...
Create Date: 2007-11-05
CID: 16757263

2629. Dipyridamole Analogue, 24; CHEMBL242010; BDBM23642 ...
MW:     392.499080 g/mol MF: C18H32N8O2
IUPAC name: 2-[[4,8-bis(diethylamino)-2-(2-hydroxyethylamino)pyrimido[5,...
Create Date: 2007-11-05
CID: 16757173

2630. Dipyridamole Analogue, 15; CHEMBL242657; BDBM23633 ...
MW:     588.785080 g/mol MF: C30H52N8O4
IUPAC name: 2-[[4,8-bis(azonan-1-yl)-2-[bis(2-hydroxyethyl)amino]pyrimid...
Create Date: 2007-11-05
CID: 16757077

2631. Dipyridamole Analogue, 14; CHEMBL437946; BDBM23632 ...
MW:     472.626800 g/mol MF: C24H40N8O2
IUPAC name: 2-[[4,8-bis(azocan-1-yl)-2-(2-hydroxyethylamino)pyrimido[5,4...
Create Date: 2007-11-05
CID: 16757076

2632. Dipyridamole Analogue, 12; CHEMBL394768; BDBM23630 ...
MW:     444.573640 g/mol MF: C22H36N8O2
IUPAC name: 2-[[4,8-bis(azepan-1-yl)-2-(2-hydroxyethylamino)pyrimido[5,4...
Create Date: 2007-11-05
CID: 16757075

2633. Dipyridamole Analogue, 40; CHEMBL242463; BDBM23658 ...
MW:     396.444720 g/mol MF: C16H28N8O4
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis(methylamino)pyrimid...
Create Date: 2007-11-05
CID: 16756652

2634. Dipyridamole Analogue, 38; CHEMBL388874; BDBM23656 ...
MW:     640.776600 g/mol MF: C38H40N8O2
IUPAC name: 2-[[4,8-bis(dibenzylamino)-2-(2-hydroxyethylamino)pyrimido[5...
Create Date: 2007-11-05
CID: 16756651

2635. Dipyridamole Analogue, 36; CHEMBL242249; BDBM23654 ...
MW:     512.603000 g/mol MF: C22H40N8O6
IUPAC name: 2-[[4,8-bis[bis(2-methoxyethyl)amino]-2-(2-hydroxyethylamino...
Create Date: 2007-11-05
CID: 16756650

2636. Dipyridamole Analogue, 34; CHEMBL395739; BDBM23652 ...
MW:     560.818040 g/mol MF: C30H56N8O2
IUPAC name: 2-[[4,8-bis[bis(3-methylbutyl)amino]-2-(2-hydroxyethylamino)...
Create Date: 2007-11-05
CID: 16756649

2637. Dipyridamole Analogue, 31; CHEMBL397279; BDBM23649 ...
MW:     648.923160 g/mol MF: C34H64N8O4
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis(dipentylamino)pyrim...
Create Date: 2007-11-05
CID: 16756648

2638. Dipyridamole Analogue, 29; CHEMBL397278; BDBM23647 ...
MW:     592.816840 g/mol MF: C30H56N8O4
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis[bis(2-methylpropyl)...
Create Date: 2007-11-05
CID: 16756536

2639. Dipyridamole Analogue, 27; CHEMBL396556; BDBM23645 ...
MW:     592.816840 g/mol MF: C30H56N8O4
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis(dibutylamino)pyrimi...
Create Date: 2007-11-05
CID: 16756535

2640. Dipyridamole Analogue, 25; CHEMBL245020; BDBM23643 ...
MW:     536.710520 g/mol MF: C26H48N8O4
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis(dipropylamino)pyrim...
Create Date: 2007-11-05
CID: 16756534

2641. Dipyridamole Analogue, 22; CHEMBL245240; BDBM23640 ...
MW:     336.392760 g/mol MF: C14H24N8O2
IUPAC name: 2-[[4,8-bis(dimethylamino)-2-(2-hydroxyethylamino)pyrimido[5...
Create Date: 2007-11-05
CID: 16756533

2642. Dipyridamole Analogue, 16; CHEMBL429101; BDBM23634 ...
MW:     500.679960 g/mol MF: C26H44N8O2
IUPAC name: 2-[[4,8-bis(azonan-1-yl)-2-(2-hydroxyethylamino)pyrimido[5,4...
Create Date: 2007-11-05
CID: 16756416

2643. Dipyridamole Analogue, 13; CHEMBL243304; BDBM23631 ...
MW:     560.731920 g/mol MF: C28H48N8O4
IUPAC name: 2-[[4,8-bis(azocan-1-yl)-2-[bis(2-hydroxyethyl)amino]pyrimid...
Create Date: 2007-11-05
CID: 16756415

2644. Dipyridamole Analogue, 11; CHEMBL243096; BDBM23629 ...
MW:     532.678760 g/mol MF: C26H44N8O4
IUPAC name: 2-[[4,8-bis(azepan-1-yl)-2-[bis(2-hydroxyethyl)amino]pyrimid...
Create Date: 2007-11-05
CID: 16756414

2645. Dipyridamole Analogue, 79; CHEMBL242027; BDBM23697 ...
MW:     588.785080 g/mol MF: C30H52N8O4
IUPAC name: 2-[[2-[2-hydroxyethyl(2-propan-2-yloxyethyl)amino]-4,8-di(pi...
Create Date: 2007-11-05
CID: 16756299

2646. Dipyridamole Analogue, 78; CHEMBL245256; BDBM23696 ...
MW:     672.944560 g/mol MF: C36H64N8O4
IUPAC name: 4,8-di(piperidin-1-yl)-2-N,2-N,6-N,6-N-tetrakis(2-propoxyeth...
Create Date: 2007-11-05
CID: 16756298

2647. Dipyridamole Analogue, 69; CHEMBL442097; BDBM23687 ...
MW:     432.478360 g/mol MF: C22H24N8O2
IUPAC name: 2-[[4,8-dianilino-2-(2-hydroxyethylamino)pyrimido[5,4-d]pyri...
Create Date: 2007-11-05
CID: 16756195

2648. Dipyridamole Analogue, 68; CHEMBL396741; BDBM23686 ...
MW:     520.583480 g/mol MF: C26H32N8O4
IUPAC name: 2-[[4,8-dianilino-2-[bis(2-hydroxyethyl)amino]pyrimido[5,4-d...
Create Date: 2007-11-05
CID: 16756194

2649. Dipyridamole Analogue, 67; CHEMBL242448; BDBM23685 ...
MW:     444.573640 g/mol MF: C22H36N8O2
IUPAC name: 2-[[4,8-bis(cyclohexylamino)-2-(2-hydroxyethylamino)pyrimido...
Create Date: 2007-11-05
CID: 16756087

2650. Dipyridamole Analogue, 66; CHEMBL395264; BDBM23684 ...
MW:     532.678760 g/mol MF: C26H44N8O4
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis(cyclohexylamino)pyr...
Create Date: 2007-11-05
CID: 16756086

2651. Dipyridamole Analogue, 65; CHEMBL242231; BDBM23683 ...
MW:     416.520480 g/mol MF: C20H32N8O2
IUPAC name: 2-[[4,8-bis(cyclopentylamino)-2-(2-hydroxyethylamino)pyrimid...
Create Date: 2007-11-05
CID: 16756085

2652. Dipyridamole Analogue, 64; CHEMBL396717; BDBM23682 ...
MW:     504.625600 g/mol MF: C24H40N8O4
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis(cyclopentylamino)py...
Create Date: 2007-11-05
CID: 16756084

2653. Dipyridamole Analogue, 63; CHEMBL242228; BDBM23681 ...
MW:     388.467320 g/mol MF: C18H28N8O2
IUPAC name: 2-[[4,8-bis(cyclobutylamino)-2-(2-hydroxyethylamino)pyrimido...
Create Date: 2007-11-05
CID: 16756083

2654. Dipyridamole Analogue, 62; CHEMBL242445; BDBM23680 ...
MW:     476.572440 g/mol MF: C22H36N8O4
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis(cyclobutylamino)pyr...
Create Date: 2007-11-05
CID: 16756082

2655. Dipyridamole Analogue, 61; CHEMBL243526; BDBM23679 ...
MW:     360.414160 g/mol MF: C16H24N8O2
IUPAC name: 2-[[4,8-bis(cyclopropylamino)-2-(2-hydroxyethylamino)pyrimid...
Create Date: 2007-11-05
CID: 16755982

2656. Dipyridamole Analogue, 60; CHEMBL242647; BDBM23678 ...
MW:     448.519280 g/mol MF: C20H32N8O4
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis(cyclopropylamino)py...
Create Date: 2007-11-05
CID: 16755981

2657. Dipyridamole Analogue, 57; CHEMBL242278; BDBM23675 ...
MW:     420.552240 g/mol MF: C20H36N8O2
IUPAC name: 2-[[2-(2-hydroxyethylamino)-4,8-bis(3-methylbutylamino)pyrim...
Create Date: 2007-11-05
CID: 16755978

2658. Dipyridamole Analogue, 56; CHEMBL243548; BDBM23674 ...
MW:     508.657360 g/mol MF: C24H44N8O4
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis(3-methylbutylamino)...
Create Date: 2007-11-05
CID: 16755977

2659. Dipyridamole Analogue, 55; CHEMBL243329; BDBM23673 ...
MW:     420.552240 g/mol MF: C20H36N8O2
IUPAC name: 2-[[2-(2-hydroxyethylamino)-4,8-bis(pentylamino)pyrimido[5,4...
Create Date: 2007-11-05
CID: 16755883

2660. Dipyridamole Analogue, 54; CHEMBL395530; BDBM23672 ...
MW:     508.657360 g/mol MF: C24H44N8O4
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis(pentylamino)pyrimid...
Create Date: 2007-11-05
CID: 16755882

2661. Dipyridamole Analogue, 53; CHEMBL243328; BDBM23671
MW:     392.499080 g/mol MF: C18H32N8O2
IUPAC name: 2-[[4,8-bis(tert-butylamino)-2-(2-hydroxyethylamino)pyrimido...
Create Date: 2007-11-05
CID: 16755881

2662. Dipyridamole Analogue, 52; CHEMBL395529; BDBM23670
MW:     480.604200 g/mol MF: C22H40N8O4
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis(tert-butylamino)pyr...
Create Date: 2007-11-05
CID: 16755880

2663. Dipyridamole Analogue, 51; CHEMBL243118; BDBM23669 ...
MW:     392.499080 g/mol MF: C18H32N8O2
IUPAC name: 2-[[2-(2-hydroxyethylamino)-4,8-bis(2-methylpropylamino)pyri...
Create Date: 2007-11-05
CID: 16755879

2664. Dipyridamole Analogue, 50; CHEMBL243119; BDBM23668 ...
MW:     480.604200 g/mol MF: C22H40N8O4
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis(2-methylpropylamino...
Create Date: 2007-11-05
CID: 16755878

2665. Isoquinoline Analogue, 49; CHEMBL439007; BDBM20355 ...
MW:     469.502050 g/mol MF: C25H26F3N5O
IUPAC name: 1-(3-aminoisoquinolin-5-yl)-3-[[4-[(1R,5S)-8-azabicyclo[3.2....
Create Date: 2007-10-15
CID: 16749243

2666. Isoquinoline Analogue, 43; CHEMBL231517; BDBM20349 ...
MW:     442.476710 g/mol MF: C24H25F3N4O
IUPAC name: 1-[[4-(azepan-1-yl)-2-(trifluoromethyl)phenyl]methyl]-3-isoq...
Create Date: 2007-10-15
CID: 16749240

2667. Isoquinoline Analogue, 38; CHEMBL231206; BDBM20344 ...
MW:     386.489440 g/mol MF: C24H26N4O
IUPAC name: 1-[[4-[(1S,5R)-8-azabicyclo[3.2.1]octan-8-yl]phenyl]methyl]-...
Create Date: 2007-10-15
CID: 16749139

2668. Isoquinoline Analogue, 34; CHEMBL231104; BDBM20340 ...
MW:     374.478740 g/mol MF: C23H26N4O
IUPAC name: 1-isoquinolin-5-yl-3-[[4-(4-methylpiperidin-1-yl)phenyl]meth...
Create Date: 2007-10-15
CID: 16749136

2669. Isoquinoline Analogue, 31; CHEMBL230997; BDBM20337 ...
MW:     360.452160 g/mol MF: C22H24N4O
IUPAC name: 1-isoquinolin-5-yl-3-[(4-piperidin-1-ylphenyl)methyl]urea
Create Date: 2007-10-15
CID: 16749133

2670. Isoquinoline Analogue, 48; CHEMBL230379; BDBM20354 ...
MW:     426.485423 g/mol MF: C26H23FN4O
IUPAC name: 1-[[4-(1,3-dihydroisoindol-2-yl)-3-fluorophenyl]methyl]-3-(3...
Create Date: 2007-10-15
CID: 16748248

2671. Isoquinoline Analogue, 44; CHEMBL397272; BDBM20350 ...
MW:     442.476710 g/mol MF: C24H25F3N4O
IUPAC name: 1-[[4-(azepan-1-yl)-3-(trifluoromethyl)phenyl]methyl]-3-isoq...
Create Date: 2007-10-15
CID: 16748127

2672. Isoquinoline Analogue, 42; CHEMBL427111; BDBM20348 ...
MW:     408.923800 g/mol MF: C23H25ClN4O
IUPAC name: 1-[[4-(azepan-1-yl)-2-chlorophenyl]methyl]-3-isoquinolin-5-y...
Create Date: 2007-10-15
CID: 16748125

2673. aminothiazole analogue, 29; SCHEMBL4601056; BDBM25685 ...
MW:     370.264740 g/mol MF: C14H16BrN3O2S
IUPAC name: 4-[(5-bromo-1,3-thiazol-2-yl)amino]-N-(2-methoxyethyl)-N-met...
Create Date: 2007-05-29
CID: 16068958

2674. aminothiazole analogue, 28; SCHEMBL4601937; BDBM25684 ...
MW:     370.264740 g/mol MF: C14H16BrN3O2S
IUPAC name: 4-[(5-bromo-1,3-thiazol-2-yl)amino]-N-(1-methoxypropan-2-yl)...
Create Date: 2007-05-29
CID: 16068957

2675. aminothiazole analogue, 33; SCHEMBL4600038; BDBM25689 ...
MW:     395.317260 g/mol MF: C16H19BrN4OS
IUPAC name: 4-[(5-bromo-1,3-thiazol-2-yl)amino]-N-(2-pyrrolidin-1-ylethy...
Create Date: 2007-05-29
CID: 16068956

2676. aminothiazole analogue, 19; SCHEMBL4602615; BDBM25675 ...
MW:     300.131840 g/mol MF: C9H6BrN3O2S
IUPAC name: 5-bromo-N-(4-nitrophenyl)-1,3-thiazol-2-amine
Create Date: 2007-05-29
CID: 16068855

2677. aminothiazole analogue, 16; SCHEMBL4600345; BDBM25672 ...
MW:     347.229640 g/mol MF: C15H11BrN2OS
IUPAC name: 5-bromo-N-(4-phenoxyphenyl)-1,3-thiazol-2-amine
Create Date: 2007-05-29
CID: 16068854

2678. aminothiazole analogue, 38; SCHEMBL4601253; BDBM25694 ...
MW:     301.225860 g/mol MF: C10H9BrN2S2
IUPAC name: 5-bromo-N-(3-methylsulfanylphenyl)-1,3-thiazol-2-amine
Create Date: 2007-05-29
CID: 16068852

2679. aminothiazole analogue, 39; SCHEMBL4601587; BDBM25695 ...
MW:     280.143740 g/mol MF: C10H6BrN3S
IUPAC name: 3-[(5-bromo-1,3-thiazol-2-yl)amino]benzonitrile
Create Date: 2007-05-29
CID: 16068851

2680. aminothiazole analogue, 44; SCHEMBL4602001; BDBM25700 ...
MW:     273.124743 g/mol MF: C9H6BrFN2S
IUPAC name: 5-bromo-N-(2-fluorophenyl)-1,3-thiazol-2-amine
Create Date: 2007-05-29
CID: 16068850

2681. aminothiazole analogue, 59; SCHEMBL4601921; BDBM25715 ...
MW:     305.192960 g/mol MF: C13H9BrN2S
IUPAC name: 5-bromo-N-naphthalen-1-yl-1,3-thiazol-2-amine
Create Date: 2007-05-29
CID: 16068849

2682. aminothiazole analogue, 45; SCHEMBL4600197; BDBM25701 ...
MW:     269.160860 g/mol MF: C10H9BrN2S
IUPAC name: 5-bromo-N-(2-methylphenyl)-1,3-thiazol-2-amine
Create Date: 2007-05-29
CID: 16068848

2683. aminothiazole analogue, 12; SCHEMBL4601192; BDBM25668 ...
MW:     280.143740 g/mol MF: C10H6BrN3S
IUPAC name: 4-[(5-bromo-1,3-thiazol-2-yl)amino]benzonitrile
Create Date: 2007-05-29
CID: 16068847

2684. aminothiazole analogue, 47; SCHEMBL4601325; BDBM25703 ...
MW:     285.160260 g/mol MF: C10H9BrN2OS
IUPAC name: 5-bromo-N-(2-methoxyphenyl)-1,3-thiazol-2-amine
Create Date: 2007-05-29
CID: 16068742

2685. aminothiazole analogue, 40; SCHEMBL4601399; BDBM25696 ...
MW:     327.196940 g/mol MF: C12H11BrN2O2S
IUPAC name: ethyl 3-[(5-bromo-1,3-thiazol-2-yl)amino]benzoate
Create Date: 2007-05-29
CID: 16068741

2686. aminothiazole analogue, 11; SCHEMBL4601021; BDBM25667 ...
MW:     323.132250 g/mol MF: C10H6BrF3N2S
IUPAC name: 5-bromo-N-[4-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine
Create Date: 2007-05-29
CID: 16068740

2687. aminothiazole analogue, 61; SCHEMBL4601125; BDBM25717 ...
MW:     256.122340 g/mol MF: C8H6BrN3S
IUPAC name: 5-bromo-N-pyridin-3-yl-1,3-thiazol-2-amine
Create Date: 2007-05-29
CID: 16068739

2688. aminothiazole analogue, 62; SCHEMBL4601048; BDBM25718 ...
MW:     256.122340 g/mol MF: C8H6BrN3S
IUPAC name: 5-bromo-N-pyridin-4-yl-1,3-thiazol-2-amine
Create Date: 2007-05-29
CID: 16068738

2689. aminothiazole analogue, 23; SCHEMBL3643316; BDBM25679 ...
MW:     327.196940 g/mol MF: C12H11BrN2O2S
IUPAC name: ethyl 4-[(5-bromo-1,3-thiazol-2-yl)amino]benzoate
Create Date: 2007-05-29
CID: 16068737

2690. aminothiazole analogue, 18; SCHEMBL4601715; BDBM25674 ...
MW:     297.170960 g/mol MF: C11H9BrN2OS
IUPAC name: 1-[4-[(5-bromo-1,3-thiazol-2-yl)amino]phenyl]ethanone
Create Date: 2007-05-29
CID: 16068736

2691. aminothiazole analogue, 20; SCHEMBL4613372; BDBM25676 ...
MW:     270.148920 g/mol MF: C9H8BrN3S
IUPAC name: 4-N-(5-bromo-1,3-thiazol-2-yl)benzene-1,4-diamine
Create Date: 2007-05-29
CID: 16068735

2692. aminothiazole analogue, 35; SCHEMBL4601487; BDBM25691 ...
MW:     269.160860 g/mol MF: C10H9BrN2S
IUPAC name: 5-bromo-N-(3-methylphenyl)-1,3-thiazol-2-amine
Create Date: 2007-05-29
CID: 16068734

2693. aminothiazole analogue, 37; SCHEMBL4601039; BDBM25693 ...
MW:     285.160260 g/mol MF: C10H9BrN2OS
IUPAC name: 5-bromo-N-(3-methoxyphenyl)-1,3-thiazol-2-amine
Create Date: 2007-05-29
CID: 16068639

2694. aminothiazole analogue, 36; SCHEMBL4601020; BDBM25692 ...
MW:     323.132250 g/mol MF: C10H6BrF3N2S
IUPAC name: 5-bromo-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine
Create Date: 2007-05-29
CID: 16068638

2695. aminothiazole analogue, 34; SCHEMBL4600760; BDBM25690 ...
MW:     273.124743 g/mol MF: C9H6BrFN2S
IUPAC name: 5-bromo-N-(3-fluorophenyl)-1,3-thiazol-2-amine
Create Date: 2007-05-29
CID: 16068637

2696. N-(5-bromo-1,3-thiazol-2-yl)benzamide; aminothiazole analogue, 56; SCHEMBL836669 ...
MW:     283.144380 g/mol MF: C10H7BrN2OS
IUPAC name: N-(5-bromo-1,3-thiazol-2-yl)benzamide
Create Date: 2007-05-29
CID: 16068636

2697. aminothiazole analogue, 31; SCHEMBL4600687; BDBM25687 ...
MW:     397.333140 g/mol MF: C16H21BrN4OS
IUPAC name: 4-[(5-bromo-1,3-thiazol-2-yl)amino]-N-[2-(diethylamino)ethyl...
Create Date: 2007-05-29
CID: 16068635

2698. aminothiazole analogue, 30; SCHEMBL4599626; BDBM25686 ...
MW:     369.279980 g/mol MF: C14H17BrN4OS
IUPAC name: 4-[(5-bromo-1,3-thiazol-2-yl)amino]-N-[2-(dimethylamino)ethy...
Create Date: 2007-05-29
CID: 16068634

2699. aminothiazole analogue, 26; SCHEMBL4601463; BDBM25682 ...
MW:     342.211580 g/mol MF: C12H12BrN3O2S
IUPAC name: 4-[(5-bromo-1,3-thiazol-2-yl)amino]-N-(2-hydroxyethyl)benzam...
Create Date: 2007-05-29
CID: 16068633

2700. aminothiazole analogue, 17; SCHEMBL4601246; BDBM25673 ...
MW:     348.217700 g/mol MF: C14H10BrN3OS
IUPAC name: 5-bromo-N-(4-pyridin-4-yloxyphenyl)-1,3-thiazol-2-amine
Create Date: 2007-05-29
CID: 16068631

2701. aminothiazole analogue, 43; SCHEMBL4602386; BDBM25699 ...
MW:     312.185600 g/mol MF: C11H10BrN3OS
IUPAC name: 3-[(5-bromo-1,3-thiazol-2-yl)amino]-N-methylbenzamide
Create Date: 2007-05-29
CID: 16068530

2702. aminothiazole analogue, 42; SCHEMBL4601318; BDBM25698 ...
MW:     356.238160 g/mol MF: C13H14BrN3O2S
IUPAC name: 3-[(5-bromo-1,3-thiazol-2-yl)amino]-N-(2-methoxyethyl)benzam...
Create Date: 2007-05-29
CID: 16068529

2703. aminothiazole analogue, 22; SCHEMBL4601358; BDBM25678 ...
MW:     312.185600 g/mol MF: C11H10BrN3OS
IUPAC name: N-[4-[(5-bromo-1,3-thiazol-2-yl)amino]phenyl]acetamide
Create Date: 2007-05-29
CID: 16068528

2704. aminothiazole analogue, 21; SCHEMBL4600739; BDBM25677 ...
MW:     374.254980 g/mol MF: C16H12BrN3OS
IUPAC name: N-[4-[(5-bromo-1,3-thiazol-2-yl)amino]phenyl]benzamide
Create Date: 2007-05-29
CID: 16068527

2705. aminothiazole analogue, 41; SCHEMBL4600869; BDBM25697 ...
MW:     299.143780 g/mol MF: C10H7BrN2O2S
IUPAC name: 3-[(5-bromo-1,3-thiazol-2-yl)amino]benzoic acid
Create Date: 2007-05-29
CID: 16068526

2706. aminothiazole analogue, 27; SCHEMBL4601137; BDBM25683 ...
MW:     356.238160 g/mol MF: C13H14BrN3O2S
IUPAC name: 4-[(5-bromo-1,3-thiazol-2-yl)amino]-N-(2-methoxyethyl)benzam...
Create Date: 2007-05-29
CID: 16068524

2707. aminothiazole analogue, 32; SCHEMBL4614085; BDBM25688 ...
MW:     411.316660 g/mol MF: C16H19BrN4O2S
IUPAC name: 4-[(5-bromo-1,3-thiazol-2-yl)amino]-N-(2-morpholin-4-ylethyl...
Create Date: 2007-05-29
CID: 16068523

2708. aminothiazole analogue, 24; SCHEMBL4601382; BDBM25680 ...
MW:     299.143780 g/mol MF: C10H7BrN2O2S
IUPAC name: 4-[(5-bromo-1,3-thiazol-2-yl)amino]benzoic acid
Create Date: 2007-05-29
CID: 16068522

2709. aminothiazole analogue, 13; SCHEMBL4600388; BDBM25669 ...
MW:     271.133680 g/mol MF: C9H7BrN2OS
IUPAC name: 4-[(5-bromo-1,3-thiazol-2-yl)amino]phenol
Create Date: 2007-05-29
CID: 16068432

2710. aminothiazole analogue, 10; SCHEMBL4600989; BDBM25666 ...
MW:     269.160860 g/mol MF: C10H9BrN2S
IUPAC name: 5-bromo-N-(4-methylphenyl)-1,3-thiazol-2-amine
Create Date: 2007-05-29
CID: 16068431

2711. pyridylthiophene analog 17; BDBM9099; CHEMBL408036 ...
MW:     875.782930 g/mol MF: C41H43Cl2F3N6O6S
IUPAC name: (2S)-4-[2-[5-(4-chlorophenyl)-1,3-oxazol-2-yl]propan-2-yl]-1...
Create Date: 2007-03-08
CID: 15955615

2712. pyridylthiophene analog 16; BDBM9098; CHEMBL380591 ...
MW:     841.337870 g/mol MF: C41H44ClF3N6O6S
IUPAC name: (2S)-4-[2-[5-(4-chlorophenyl)-1,3-oxazol-2-yl]propan-2-yl]-1...
Create Date: 2007-03-08
CID: 15955614

2713. pyridylthiophene analog 13; BDBM9095; CHEMBL197039 ...
MW:     862.903219 g/mol MF: C40H40F6N6O5S2
IUPAC name: (2S)-1-[(2S,4S)-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4-dihydro-...
Create Date: 2007-03-08
CID: 15955612

2714. pyridylthiophene analog 12; BDBM9094; CHEMBL199209 ...
MW:     828.362250 g/mol MF: C40H41ClF3N5O5S2
IUPAC name: (2S)-4-[[5-(4-chlorophenyl)thiophen-2-yl]methyl]-1-[(2S,4S)-...
Create Date: 2007-03-08
CID: 15955611

2715. pyridylthiophene analog 11; BDBM9093; CHEMBL197493 ...
MW:     812.296650 g/mol MF: C40H41ClF3N5O6S
IUPAC name: (2S)-4-[[5-(4-chlorophenyl)furan-2-yl]methyl]-1-[(2S,4S)-2-h...
Create Date: 2007-03-08
CID: 15955610

2716. pyridylthiophene analog 10; BDBM9092; CHEMBL382951 ...
MW:     857.403470 g/mol MF: C41H44ClF3N6O5S2
IUPAC name: (2S)-4-[2-[5-(4-chlorophenyl)-1,3-thiazol-2-yl]propan-2-yl]-...
Create Date: 2007-03-08
CID: 15955609

2717. P3 arylpyrrole analog 21; BDBM9140; CHEMBL334379 ...
MW:     774.751819 g/mol MF: C38H40F6N6O5
IUPAC name: (2S)-1-[(2S,4R)-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4-dihydro-...
Create Date: 2007-03-08
CID: 15954476

2718. P3 arylpyrrole analog 20; BDBM9139; CHEMBL128395 ...
MW:     824.115610 g/mol MF: C38H40Cl3F3N6O5
IUPAC name: (2S)-1-[(2S,4R)-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4-dihydro-...
Create Date: 2007-03-08
CID: 15954475

2719. P3 arylpyrrole analog 19; BDBM9138; CHEMBL338142 ...
MW:     789.670550 g/mol MF: C38H41Cl2F3N6O5
IUPAC name: (2S)-4-[[1-(3,4-dichlorophenyl)pyrrol-3-yl]methyl]-1-[(2S,4R...
Create Date: 2007-03-08
CID: 15954474

2720. P3 arylpyrrole analog 17; BDBM9136; CHEMBL340733 ...
MW:     734.807010 g/mol MF: C39H45F3N6O5
IUPAC name: (2S)-1-[(2S,4R)-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4-dihydro-...
Create Date: 2007-03-08
CID: 15954473

2721. P3 arylpyrrole analog 16; BDBM9135; CHEMBL128336 ...
MW:     738.770893 g/mol MF: C38H42F4N6O5
IUPAC name: (2S)-4-[[1-(4-fluorophenyl)pyrrol-3-yl]methyl]-1-[(2S,4R)-2-...
Create Date: 2007-03-08
CID: 15954472

2722. P3 arylpyrrole analog 15; BDBM9134; CHEMBL334572 ...
MW:     745.789890 g/mol MF: C39H42F3N7O5
IUPAC name: (2S)-4-[[1-(4-cyanophenyl)pyrrol-3-yl]methyl]-1-[(2S,4R)-2-h...
Create Date: 2007-03-08
CID: 15954471

2723. P3 arylpyrrole analog 14; BDBM9133; CHEMBL334573 ...
MW:     788.778399 g/mol MF: C39H42F6N6O5
IUPAC name: (2S)-1-[(2S,4R)-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4-dihydro-...
Create Date: 2007-03-08
CID: 15954470

2724. P3 arylpyrrole analog 12; BDBM9131; CHEMBL341176 ...
MW:     734.807010 g/mol MF: C39H45F3N6O5
IUPAC name: (2S)-1-[(2S,4R)-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4-dihydro-...
Create Date: 2007-03-08
CID: 15954469

2725. P3 arylpyrrole analog 11; BDBM9130; CHEMBL340729 ...
MW:     738.770893 g/mol MF: C38H42F4N6O5
IUPAC name: (2S)-4-[[1-(3-fluorophenyl)pyrrol-3-yl]methyl]-1-[(2S,4R)-2-...
Create Date: 2007-03-08
CID: 15954468

2726. P3 arylpyrrole analog 10; BDBM9129; CHEMBL276121 ...
MW:     745.789890 g/mol MF: C39H42F3N7O5
IUPAC name: (2S)-4-[[1-(3-cyanophenyl)pyrrol-3-yl]methyl]-1-[(2S,4R)-2-h...
Create Date: 2007-03-08
CID: 15954467

2727. arylsulfonamide analogue 16; BDBM12052; (S)-3-(4-Methyl-biphenyl-2-sulfonylamino)-4-oxo-butyric acid ...
MW:     347.385580 g/mol MF: C17H17NO5S
IUPAC name: (3S)-3-[[2-(4-methylphenyl)phenyl]sulfonylamino]-4-oxobutano...
Create Date: 2007-02-12
CID: 15888284

2728. arylsulfonamide analogue 11; BDBM12047; (3S)-3-benzenesulfonamido-4-oxobutanoic acid ...
MW:     257.263040 g/mol MF: C10H11NO5S
IUPAC name: (3S)-3-(benzenesulfonamido)-4-oxobutanoic acid
Create Date: 2007-02-12
CID: 15888279

2729. Dipyridamole Analogue, 77; CHEMBL277508; BDBM23695 ...
MW:     616.838240 g/mol MF: C32H56N8O4
IUPAC name: 2-N,2-N,6-N,6-N-tetrakis(2-ethoxyethyl)-4,8-di(piperidin-1-y...
Create Date: 2007-02-08
CID: 13066250

2730. 3,5-dimethylphenserine; Phenserine methyl analog 9; CHEMBL131210 ...
MW:     365.468680 g/mol MF: C22H27N3O2
IUPAC name: [(3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]in...
Create Date: 2007-02-08
CID: 13006039

2731. 3,4-dimethylphrnserine; Phenserine methyl analog 8; CHEMBL130672 ...
MW:     365.468680 g/mol MF: C22H27N3O2
IUPAC name: [(3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]in...
Create Date: 2007-02-08
CID: 13006038

2732. 2,3-dimethylphenserine; Phenserine methyl analog 7; CHEMBL335962 ...
MW:     365.468680 g/mol MF: C22H27N3O2
IUPAC name: [(3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]in...
Create Date: 2007-02-08
CID: 13006037

2733. Phenserine methyl analog 6; CHEMBL131598; BDBM10974 ...
MW:     351.442100 g/mol MF: C21H25N3O2
IUPAC name: [(3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]in...
Create Date: 2007-02-08
CID: 13006036

2734. 2,4-dimethylphenserine; Phenserine methyl analog 5; CHEMBL335220 ...
MW:     365.468680 g/mol MF: C22H27N3O2
IUPAC name: [(3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]in...
Create Date: 2007-02-08
CID: 13006035

2735. 4-methylphenserine; Phenserine methyl analog 4; CHEMBL130956 ...
MW:     351.442100 g/mol MF: C21H25N3O2
IUPAC name: [(3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]in...
Create Date: 2007-02-08
CID: 13006034

2736. Pyrrolocarbazole Analog 22; CHEMBL374639; BDBM14180 ...
MW:     312.321480 g/mol MF: C20H12N2O2
Create Date: 2007-02-08
CID: 12970028

2737. 7,8-dimethoxyphenanthridine; chelerythrine analogue, 11; 7,8-dimethoxy-phenanthridine ...
MW:     239.269220 g/mol MF: C15H13NO2
IUPAC name: 7,8-dimethoxyphenanthridine
Create Date: 2007-02-08
CID: 12703531

2738. aminothiazole analogue, 14; SCHEMBL3597606; BDBM25670 ...
MW:     285.160260 g/mol MF: C10H9BrN2OS
IUPAC name: 5-bromo-N-(4-methoxyphenyl)-1,3-thiazol-2-amine
Create Date: 2007-02-07
CID: 12348632

2739. AZD0530 analogue 42; CHEMBL214894; BDBM12264 ...
MW:     556.053060 g/mol MF: C28H34ClN5O5
IUPAC name: N-(6-chloro-2,3-dihydro-1,4-benzodioxin-5-yl)-7-[2-(4-methyl...
Create Date: 2007-01-03
CID: 11974331

2740. AZD0530 analogue 41; CHEMBL215087; BDBM12263 ...
MW:     527.011840 g/mol MF: C27H31ClN4O5
IUPAC name: N-(6-chloro-2,3-dihydro-1,4-benzodioxin-5-yl)-5-(oxan-4-ylox...
Create Date: 2007-01-03
CID: 11974330

2741. AZD0530 analogue 40; CHEMBL426148; BDBM12262 ...
MW:     542.069540 g/mol MF: C28H36ClN5O4
IUPAC name: N-(2-chloro-5-methoxyphenyl)-6-[3-(4-methylpiperazin-1-yl)pr...
Create Date: 2007-01-03
CID: 11974329

2742. AZD0530 analogue 39; CHEMBL217088; SCHEMBL6977898 ...
MW:     345.780240 g/mol MF: C17H16ClN3O3
IUPAC name: N-(2-chloro-5-methoxyphenyl)-5,7-dimethoxyquinazolin-4-amine
Create Date: 2007-01-03
CID: 11974219

2743. AZD0530 analogue 38; CHEMBL217977; BDBM12260 ...
MW:     428.911900 g/mol MF: C22H25ClN4O3
IUPAC name: N-(2-chloro-5-methoxyphenyl)-6-methoxy-5-(1-methylpiperidin-...
Create Date: 2007-01-03
CID: 11974217

2744. AZD0530 analogue 32; CHEMBL386996; BDBM12254 ...
MW:     511.545303 g/mol MF: C26H30FN5O5
IUPAC name: 1-[4-[2-[4-[(5-fluoro-1,3-benzodioxol-4-yl)amino]-5-propan-2...
Create Date: 2007-01-03
CID: 11974215

2745. AZD0530 analogue 31; CHEMBL436968; BDBM12253 ...
MW:     486.947980 g/mol MF: C24H27ClN4O5
IUPAC name: N-(5-chloro-1,3-benzodioxol-4-yl)-7-(2-morpholin-4-ylethoxy)...
Create Date: 2007-01-03
CID: 11974214

2746. AZD0530 analogue 30; CHEMBL214376; BDBM12252 ...
MW:     484.975160 g/mol MF: C25H29ClN4O4
IUPAC name: N-(5-chloro-1,3-benzodioxol-4-yl)-5-propan-2-yloxy-7-(3-pyrr...
Create Date: 2007-01-03
CID: 11974213

2747. AZD0530 analogue 29; CHEMBL213762; SCHEMBL3279285 ...
MW:     484.975160 g/mol MF: C25H29ClN4O4
IUPAC name: N-(5-chloro-1,3-benzodioxol-4-yl)-5-(1-methylpiperidin-4-yl)...
Create Date: 2007-01-03
CID: 11974212

2748. AZD0530 analogue 28; CHEMBL217464; SCHEMBL3276929 ...
MW:     474.912463 g/mol MF: C23H24ClFN4O4
IUPAC name: N-(5-chloro-1,3-benzodioxol-4-yl)-7-(2-fluoroethoxy)-5-(1-me...
Create Date: 2007-01-03
CID: 11974120

2749. AZD0530 analogue 27; CHEMBL263947; SCHEMBL3277003 ...
MW:     470.948580 g/mol MF: C24H27ClN4O4
IUPAC name: N-(5-chloro-1,3-benzodioxol-4-yl)-5-(1-methylpiperidin-4-yl)...
Create Date: 2007-01-03
CID: 11974119

2750. AZD0530 analogue 26; CHEMBL439182; BDBM12248 ...
MW:     426.896020 g/mol MF: C22H23ClN4O3
IUPAC name: N-(5-chloro-1,3-benzodioxol-4-yl)-5-[(1-methylpiperidin-4-yl...
Create Date: 2007-01-03
CID: 11974118

2751. AZD0530 analogue 20; CHEMBL387093; SCHEMBL3276936 ...
MW:     497.973920 g/mol MF: C25H28ClN5O4
IUPAC name: N-(5-chloro-1,3-benzodioxol-4-yl)-5-morpholin-4-yl-7-(2-pyrr...
Create Date: 2007-01-03
CID: 11974116

2752. AZD0530 analogue 17; CHEMBL266188; BDBM12239 ...
MW:     492.566780 g/mol MF: C27H32N4O5
IUPAC name: N-(2,3-dihydro-1,4-benzodioxin-5-yl)-5-(oxan-4-yloxy)-7-(2-p...
Create Date: 2007-01-03
CID: 11974115

2753. AZD0530 analogue 14; CHEMBL385958; BDBM12236 ...
MW:     478.540200 g/mol MF: C26H30N4O5
IUPAC name: N-(1,3-benzodioxol-4-yl)-5-(oxan-4-yloxy)-7-(2-pyrrolidin-1-...
Create Date: 2007-01-03
CID: 11974021

2754. AZD0530 analogue 13; CHEMBL262721; BDBM12235 ...
MW:     422.476940 g/mol MF: C23H26N4O4
IUPAC name: N-(2,3-dihydro-1,4-benzodioxin-5-yl)-7-methoxy-5-(1-methylpi...
Create Date: 2007-01-03
CID: 11974020

2755. AZD0530 analogue 12; CHEMBL384260; BDBM12234 ...
MW:     408.450360 g/mol MF: C22H24N4O4
IUPAC name: N-(1,3-benzodioxol-4-yl)-7-methoxy-5-(1-methylpiperidin-4-yl...
Create Date: 2007-01-03
CID: 11974019

2756. AZD0530 analogue 11; CHEMBL214893; BDBM12233 ...
MW:     492.566780 g/mol MF: C27H32N4O5
IUPAC name: N-(1,3-benzodioxol-4-yl)-5-(oxan-4-yloxy)-7-(3-pyrrolidin-1-...
Create Date: 2007-01-03
CID: 11974017

2757. N-pyrazinylurea Analog 8i; CHEMBL208332; BDBM14614 ...
MW:     423.812560 g/mol MF: C19H14ClN7O3
IUPAC name: N-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methox...
Create Date: 2006-11-13
CID: 11948705

2758. Benzothiazole analogue, 9; CHEMBL211979; SCHEMBL5039560 ...
MW:     390.913500 g/mol MF: C16H15ClN6S2
IUPAC name: 9-butyl-8-[(4-chloro-1,3-benzothiazol-2-yl)sulfanyl]purin-6-...
Create Date: 2006-11-06
CID: 11850831

2759. Benzothiazole analogue, 7; CHEMBL213118; SCHEMBL1964689 ...
MW:     356.468440 g/mol MF: C16H16N6S2
IUPAC name: 8-(1,3-benzothiazol-2-ylsulfanyl)-9-butylpurin-6-amine
Create Date: 2006-11-06
CID: 11850830

2760. Benzothiazole analogue, 8; CHEMBL213119; SCHEMBL4897565 ...
MW:     390.913500 g/mol MF: C16H15ClN6S2
IUPAC name: 9-butyl-8-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]purin-6-...
Create Date: 2006-11-06
CID: 11850631

2761. Dipyridamole Analogue, 71; CHEMBL183415; BDBM23689 ...
MW:     460.531520 g/mol MF: C24H28N8O2
IUPAC name: 2-[[4,8-bis(benzylamino)-2-(2-hydroxyethylamino)pyrimido[5,4...
Create Date: 2006-10-28
CID: 11826662

2762. Fluoro-Olefin Analogue 45; CHEMBL180514; BDBM12463 ...
MW:     288.402903 g/mol MF: C18H25FN2
IUPAC name: (2E)-2-[2-(1-adamantylamino)-1-fluoroethylidene]cyclopentane...
Create Date: 2006-10-26
CID: 11784400

2763. CHEMBL251029; quinazolinone analogue, 1b; SCHEMBL6795925 ...
MW:     379.882580 g/mol MF: C22H22ClN3O
IUPAC name: 8-chloro-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-...
Create Date: 2006-10-26
CID: 11749305

2764. V11294 Analogue 5p; BDBM14380; 3-(3-Cyclopentyloxy-4-methoxy-benzyl)-8-[1-(4-trifluoromethoxy-benzyloxy)-1-methyl-ethyl]-3Hpurin-6-ylamine ...
MW:     571.590690 g/mol MF: C29H32F3N5O4
IUPAC name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[2-[[4-(trifl...
Create Date: 2006-10-26
CID: 11478659

2765. V11294 Analogue 5m; BDBM14377; 3-(3-Cyclopentyloxy-4-methoxy-benzyl)-8-[1-(4-cyano-benzyloxy)-1-methyl-ethyl]-3Hpurin-6-ylamine
MW:     512.602780 g/mol MF: C29H32N6O3
IUPAC name: 4-[2-[6-amino-3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]pu...
Create Date: 2006-10-26
CID: 11477773

2766. V11294 Analogue 5k; BDBM14375; (2E)-but-2-enedioic acid; 3-{[3-(cyclopentyloxy)-4-methoxyphenyl]methyl}-8-{2-[(3,4-difluorophenyl)methoxy]propan-2-yl}-3H-purin-6-amine ...
MW:     523.574246 g/mol MF: C28H31F2N5O3
IUPAC name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[2-[(3,4-difl...
Create Date: 2006-10-26
CID: 11456441

2767. V11294 Analogue 5b; SCHEMBL7382945; BDBM14366 ...
MW:     517.619300 g/mol MF: C29H35N5O4
IUPAC name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[2-[(2-methox...
Create Date: 2006-10-26
CID: 11443760

2768. V11294 Analogue 5e; BDBM14369; 3-(3-Cyclopentyloxy-4-methoxy-benzyl)-8-[1-(4-methyl-benzyloxy)-1-methyl-ethyl]-3H-purin-6-ylamine ...
MW:     501.619900 g/mol MF: C29H35N5O3
IUPAC name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[2-[(4-methyl...
Create Date: 2006-10-26
CID: 11443441

2769. V11294 Analogue 8a; BDBM14387; 8-(1-Benzyloxy-ethyl)-3-(3-cyclopentyloxy-4-methoxy-benzyl)-3H-purin-6-ylamine ...
MW:     473.566740 g/mol MF: C27H31N5O3
IUPAC name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-(1-phenylmeth...
Create Date: 2006-10-26
CID: 11442865

2770. V11294 Analogue 5j; SCHEMBL7742225; BDBM14374 ...
MW:     547.645280 g/mol MF: C30H37N5O5
IUPAC name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[2-[(3,5-dime...
Create Date: 2006-10-26
CID: 11433798

2771. V11294 Analogue 5a; SCHEMBL7734205; BDBM14365 ...
MW:     487.593320 g/mol MF: C28H33N5O3
IUPAC name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-(2-phenylmeth...
Create Date: 2006-10-26
CID: 11386898

2772. V11294 Analogue 5i; SCHEMBL7379736; BDBM14373 ...
MW:     547.645280 g/mol MF: C30H37N5O5
IUPAC name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[2-[(3,4-dime...
Create Date: 2006-10-26
CID: 11376249

2773. V11294 Analogue 5v; BDBM14386; 3-(3-Cyclopentyloxy-4-methoxy-benzyl)-8-[1,1-dimethyl-2-(thiophen-3-yloxy)-ethyl]-3H-purin-6-ylamine ...
MW:     493.621040 g/mol MF: C26H31N5O3S
IUPAC name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-(2-methyl-1-t...
Create Date: 2006-10-26
CID: 11375325

2774. Dipyridamole Analogue, 72; CHEMBL182365; BDBM23690 ...
MW:     418.490000 g/mol MF: C20H30N6O4
IUPAC name: 2-[2-(2-hydroxyethoxy)-4,8-di(piperidin-1-yl)pyrimido[5,4-d]...
Create Date: 2006-10-26
CID: 11350617

2775. V11294 Analogue 5q; BDBM14381; 4-{2-[6-Amino-3-(3-cyclopentyloxy-4-methoxy-benzyl)-3H-purin-8-yl]-2-methyl-propoxy}-benzoic acid methyl ester
MW:     545.629400 g/mol MF: C30H35N5O5
IUPAC name: methyl 4-[2-[6-amino-3-[(3-cyclopentyloxy-4-methoxyphenyl)me...
Create Date: 2006-10-26
CID: 11318772

2776. V11294 Analogue 5h; SCHEMBL7376399; BDBM14372 ...
MW:     505.583783 g/mol MF: C28H32FN5O3
IUPAC name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[2-[(3-fluoro...
Create Date: 2006-10-26
CID: 11306698

2777. CHEMBL253275; 503166-51-6; benzimidazole analog., 32 ...
MW:     462.421750 g/mol MF: C22H21F3N4O4
IUPAC name: (3R,4R)-N-hydroxy-4-[[4-[[2-(trifluoromethyl)benzimidazol-1-...
Create Date: 2006-10-26
CID: 11294179

2778. V11294 Analogue 5d; SCHEMBL7742229; BDBM14368 ...
MW:     517.619300 g/mol MF: C29H35N5O4
IUPAC name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[2-[(4-methox...
Create Date: 2006-10-26
CID: 11283750

2779. V11294 Analogue 5o; BDBM14379; 3-(3-Cyclopentyloxy-4-methoxy-benzyl)-8-[1-(4-tert-butyl-benzyloxy)-1-methyl-ethyl]-3Hpurin-6-ylamine ...
MW:     543.699640 g/mol MF: C32H41N5O3
IUPAC name: 8-[2-[(4-tert-butylphenyl)methoxy]propan-2-yl]-3-[(3-cyclope...
Create Date: 2006-10-26
CID: 11249748

2780. V11294 Analogue 5n; BDBM14378; 3-(3-Cyclopentyloxy-4-methoxy-benzyl)-8-[1-(3,4-dichloro-benzyloxy)-1-methyl-ethyl]-3Hpurin-6-ylamine ...
MW:     556.483440 g/mol MF: C28H31Cl2N5O3
IUPAC name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[2-[(3,4-dich...
Create Date: 2006-10-26
CID: 11238279

2781. Isoquinoline Analogue, 33; CHEMBL230998; SCHEMBL4028794 ...
MW:     388.505320 g/mol MF: C24H28N4O
IUPAC name: 1-[[4-(azocan-1-yl)phenyl]methyl]-3-isoquinolin-5-ylurea
Create Date: 2006-10-26
CID: 11234633

2782. V11294 Analogue 5t; BDBM14384; 3-(3-Cyclopentyloxy-4-methoxy-benzyl)-8-[1-(4-trifluoromethyl-benzyloxy)-1-methyl-ethyl]-3H-purin-6-ylamine ...
MW:     555.591290 g/mol MF: C29H32F3N5O3
IUPAC name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[2-[[4-(trifl...
Create Date: 2006-10-26
CID: 11226695

2783. V11294 Analogue 5f; SCHEMBL7742177; BDBM14370 ...
MW:     522.038380 g/mol MF: C28H32ClN5O3
IUPAC name: 8-[2-[(4-chlorophenyl)methoxy]propan-2-yl]-3-[(3-cyclopentyl...
Create Date: 2006-10-26
CID: 11214587

2784. V11294 Analogue 5c; SCHEMBL7734270; BDBM14367 ...
MW:     517.619300 g/mol MF: C29H35N5O4
IUPAC name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[2-[(3-methox...
Create Date: 2006-10-26
CID: 11179896

2785. V11294 Analogue 5r; BDBM14382; 4-{2-[6-Amino-3-(3-cyclopentyloxy-4-methoxy-benzyl)-3H-purin-8-yl]-2-methyl-propoxy}-benzamide Fumarate
MW:     530.618060 g/mol MF: C29H34N6O4
IUPAC name: 4-[2-[6-amino-3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]pu...
Create Date: 2006-10-26
CID: 11168555

2786. Pyrrolocarbazole Analog 19; CHEMBL220799; SCHEMBL13639845 ...
MW:     328.387080 g/mol MF: C20H12N2OS
Create Date: 2006-10-26
CID: 11131268

2787. Fluoro-Olefin Analogue 44; CHEMBL366856; BDBM12462 ...
MW:     258.333863 g/mol MF: C16H19FN2
IUPAC name: (2E)-2-[1-fluoro-2-(2-phenylethylamino)ethylidene]cyclopenta...
Create Date: 2006-10-26
CID: 11122260

2788. CHEMBL116605; Aminobenzoic acid analog 5; SCHEMBL6499405 ...
MW:     663.671080 g/mol MF: C34H37N3O11
IUPAC name: 2-[4-[2-acetamido-3-[4-(3-hydroxy-2-methoxycarbonylphenoxy)b...
Create Date: 2006-10-26
CID: 11115025

2789. Fluoro-Olefin Analogue 42; CHEMBL177980; BDBM12460 ...
MW:     288.402903 g/mol MF: C18H25FN2
IUPAC name: (2Z)-2-[2-(1-adamantylamino)-1-fluoroethylidene]cyclopentane...
Create Date: 2006-10-26
CID: 11101478

2790. Fluoro-Olefin Analogue 43; CHEMBL173824; BDBM12461 ...
MW:     262.297746 g/mol MF: C15H16F2N2
IUPAC name: (2Z)-2-[1-fluoro-2-[(4-fluorophenyl)methylamino]ethylidene]c...
Create Date: 2006-10-26
CID: 11079321

2791. Combretastatin A4-analogue; NSC726217; NSC-726217
MW:     386.395180 g/mol MF: C21H22O7
IUPAC name: 3-(3,4-dimethoxyphenyl)-4-(3,4,5-trimethoxyphenyl)-2H-furan-...
Create Date: 2006-10-26
CID: 11069089

2792. Fluoro-Olefin Analogue 46; CHEMBL175966; BDBM12464 ...
MW:     262.297746 g/mol MF: C15H16F2N2
IUPAC name: (2E)-2-[1-fluoro-2-[(4-fluorophenyl)methylamino]ethylidene]c...
Create Date: 2006-10-26
CID: 11025199

2793. Pyrrolocarbazole Analog 21; CHEMBL426719; SCHEMBL13639843 ...
MW:     312.321480 g/mol MF: C20H12N2O2
Create Date: 2006-10-26
CID: 10935867

2794. Fluoro-Olefin Analogue 41; CHEMBL177265; BDBM12459 ...
MW:     258.333863 g/mol MF: C16H19FN2
IUPAC name: (2Z)-2-[1-fluoro-2-(2-phenylethylamino)ethylidene]cyclopenta...
Create Date: 2006-10-26
CID: 10872395

2795. pyrrolidinone analogue, 26; CHEMBL423995; BDBM19809 ...
MW:     622.751640 g/mol MF: C34H46N4O7
IUPAC name: benzyl N-methyl-N-[(2S)-4-methyl-1-[3-[[(2S)-4-methyl-2-[met...
Create Date: 2006-10-26
CID: 10793962

2796. pyrrolidinone analogue, 33; CHEMBL350591; BDBM19813 ...
MW:     601.735720 g/mol MF: C34H43N5O5
IUPAC name: benzyl N-[(2S)-4-methyl-1-[3-[[(2S)-4-methyl-2-(quinoline-7-...
Create Date: 2006-10-26
CID: 10722309

2797. CHEMBL118449; piperidinone analogue, 27; SCHEMBL6578212 ...
MW:     608.725060 g/mol MF: C33H44N4O7
IUPAC name: benzyl N-[(2S)-4-methyl-1-[4-[[(2S)-4-methyl-2-(phenylmethox...
Create Date: 2006-10-25
CID: 10698950

2798. piperidinone analogue, 23; CHEMBL163592; SCHEMBL6578027 ...
MW:     403.472060 g/mol MF: C21H29N3O5
IUPAC name: benzyl N-[(2S)-1-[(1-acetyl-3-oxopiperidin-4-yl)amino]-4-met...
Create Date: 2006-10-25
CID: 10668881

2799. pyrrolidinone analogue, 22; CHEMBL349445; BDBM19805 ...
MW:     389.445480 g/mol MF: C20H27N3O5
IUPAC name: benzyl N-[(2S)-1-[(1-acetyl-4-oxopyrrolidin-3-yl)amino]-4-me...
Create Date: 2006-10-25
CID: 10524384

2800. CHEMBL100563; pyrrolidinone analogue, 24; SCHEMBL6580543 ...
MW:     594.698480 g/mol MF: C32H42N4O7
IUPAC name: benzyl N-[(2S)-4-methyl-1-[3-[[(2S)-4-methyl-2-(phenylmethox...
Create Date: 2006-10-25
CID: 10507714

2801. Isoquinoline Analogue, 40; CHEMBL387579; SCHEMBL4030496 ...
MW:     389.493380 g/mol MF: C23H27N5O
IUPAC name: 1-(3-aminoisoquinolin-5-yl)-3-[[4-(azepan-1-yl)phenyl]methyl...
Create Date: 2006-10-25
CID: 10452949

2802. Isoquinoline Analogue, 32; CHEMBL387996; SCHEMBL4027894 ...
MW:     374.478740 g/mol MF: C23H26N4O
IUPAC name: 1-[[4-(azepan-1-yl)phenyl]methyl]-3-isoquinolin-5-ylurea
Create Date: 2006-10-25
CID: 10429507

2803. Isoquinoline Analogue, 29; CHEMBL387995; SCHEMBL4028805 ...
MW:     320.388300 g/mol MF: C19H20N4O
IUPAC name: 1-[[4-(dimethylamino)phenyl]methyl]-3-isoquinolin-5-ylurea
Create Date: 2006-10-25
CID: 10426159

2804. Isoquinoline Analogue, 46; CHEMBL231619; SCHEMBL4025637 ...
MW:     398.405906 g/mol MF: C21H20F2N4O2
IUPAC name: 1-[(3,5-difluoro-4-morpholin-4-ylphenyl)methyl]-3-isoquinoli...
Create Date: 2006-10-25
CID: 10386145

2805. Isoquinoline Analogue, 45; CHEMBL231518; SCHEMBL4020270 ...
MW:     392.469203 g/mol MF: C23H25FN4O
IUPAC name: 1-[[4-(azepan-1-yl)-3-fluorophenyl]methyl]-3-isoquinolin-5-y...
Create Date: 2006-10-25
CID: 10385845

2806. Isoquinoline Analogue, 36; CHEMBL387578; SCHEMBL4023595 ...
MW:     390.478140 g/mol MF: C23H26N4O2
IUPAC name: 1-[[4-(2,6-dimethylmorpholin-4-yl)phenyl]methyl]-3-isoquinol...
Create Date: 2006-10-25
CID: 10385728

2807. pyrrolidinone analogue, 25; CHEMBL348842; BDBM19808 ...
MW:     608.725060 g/mol MF: C33H44N4O7
IUPAC name: benzyl N-methyl-N-[(2S)-4-methyl-1-[3-[[(2S)-4-methyl-2-(phe...
Create Date: 2006-10-25
CID: 10348741

2808. Isoquinoline Analogue, 41; CHEMBL230689; SCHEMBL4021621 ...
MW:     396.870040 g/mol MF: C21H21ClN4O2
IUPAC name: 1-(3-chloroisoquinolin-5-yl)-3-[(4-morpholin-4-ylphenyl)meth...
Create Date: 2006-10-25
CID: 10340730

2809. Isoquinoline Analogue, 37; CHEMBL231106; SCHEMBL4022109 ...
MW:     378.490580 g/mol MF: C21H22N4OS
IUPAC name: 1-isoquinolin-5-yl-3-[(4-thiomorpholin-4-ylphenyl)methyl]ure...
Create Date: 2006-10-25
CID: 10317518

2810. AZD0530 analogue 19; SCHEMBL3195498; BDBM12241 ...
MW:     536.963600 g/mol MF: C27H25ClN4O6
IUPAC name: N-(5-chloro-1,3-benzodioxol-4-yl)-5-(oxan-4-yloxy)-7-(2-pyri...
Create Date: 2006-10-25
CID: 10302266

2811. AZD0530 analogue 18; CHEMBL216105; SCHEMBL3203800 ...
MW:     527.011840 g/mol MF: C27H31ClN4O5
IUPAC name: N-(5-chloro-1,3-benzodioxol-4-yl)-7-[(1-methylpiperidin-4-yl...
Create Date: 2006-10-25
CID: 10301885

2812. AZD0530 analogue 15; CHEMBL217090; SCHEMBL3205977 ...
MW:     527.011840 g/mol MF: C27H31ClN4O5
IUPAC name: N-(5-chloro-1,3-benzodioxol-4-yl)-5-(oxan-4-yloxy)-7-(3-pyrr...
Create Date: 2006-10-25
CID: 10301884

2813. benzimidazole analog., 20; CHEMBL251868; SCHEMBL6790949 ...
MW:     421.492180 g/mol MF: C23H27N5O3
IUPAC name: (3S,4S)-N-hydroxy-4-[[4-[(2-propan-2-ylbenzimidazol-1-yl)met...
Create Date: 2006-10-25
CID: 10295733

2814. GW708893X; benzyl amide analog., 12; CHEMBL402108 ...
MW:     417.887500 g/mol MF: C24H20ClN3O2
IUPAC name: N-[(4-chlorophenyl)methyl]-4-[2-methyl-5-(5-methyl-1,3,4-oxa...
Create Date: 2006-10-25
CID: 10295475

2815. CHEMBL381206; AZD0530 analogue 10; SCHEMBL3281905 ...
MW:     486.991040 g/mol MF: C25H31ClN4O4
IUPAC name: N-(2-chloro-5-methoxyphenyl)-7-(3-morpholin-4-ylpropoxy)-5-p...
Create Date: 2006-10-25
CID: 10288960

2816. benzimidazole analog., 26; CHEMBL252677; SCHEMBL6487834 ...
MW:     474.551500 g/mol MF: C27H30N4O4
IUPAC name: (5R,7S,8R)-8-[[4-[(2-cyclopropylbenzimidazol-1-yl)methyl]ben...
Create Date: 2006-10-25
CID: 10277120

2817. benzimidazole analog., 24; CHEMBL252481; SCHEMBL6790216 ...
MW:     473.566740 g/mol MF: C27H31N5O3
IUPAC name: (3S,4S)-4-[[4-[(2-tert-butylbenzimidazol-1-yl)methyl]benzoyl...
Create Date: 2006-10-25
CID: 10277073

2818. AZD0530 analogue 37; CHEMBL385723; SCHEMBL3196191 ...
MW:     456.922000 g/mol MF: C23H25ClN4O4
IUPAC name: N-(5-chloro-1,3-benzodioxol-4-yl)-6-methoxy-7-(3-pyrrolidin-...
Create Date: 2006-10-25
CID: 10276115

2819. benzimidazole analog., 33; CHEMBL253276; SCHEMBL6791663 ...
MW:     448.395170 g/mol MF: C21H19F3N4O4
IUPAC name: (3R,4S)-N-hydroxy-4-[[4-[[2-(trifluoromethyl)benzimidazol-1-...
Create Date: 2006-10-25
CID: 10275545

2820. AZD0530 analogue 24; SCHEMBL3193688; BDBM12246 ...
MW:     428.868840 g/mol MF: C21H21ClN4O4
IUPAC name: N-(5-chloro-1,3-benzodioxol-4-yl)-7-methoxy-5-piperidin-4-yl...
Create Date: 2006-10-25
CID: 10274208

2821. benzimidazole analog., 16; CHEMBL254722; SCHEMBL6790313 ...
MW:     425.504020 g/mol MF: C21H23N5O3S
IUPAC name: (3S,4S)-N-hydroxy-4-[[4-[(2-methylsulfanylbenzimidazol-1-yl)...
Create Date: 2006-10-25
CID: 10273985

2822. benzimidazole analog., 21; CHEMBL404673; SCHEMBL6791133 ...
MW:     420.504120 g/mol MF: C24H28N4O3
IUPAC name: N-[(1R,2S)-2-(hydroxycarbamoyl)cyclopentyl]-4-[(2-propan-2-y...
Create Date: 2006-10-25
CID: 10273657

2823. Isoquinoline Analogue, 35; CHEMBL231105; SCHEMBL4023640 ...
MW:     362.424980 g/mol MF: C21H22N4O2
IUPAC name: 1-isoquinolin-5-yl-3-[(4-morpholin-4-ylphenyl)methyl]urea
Create Date: 2006-10-25
CID: 10248092

2824. Isoquinoline Analogue, 30; CHEMBL230896; SCHEMBL4027046 ...
MW:     346.425580 g/mol MF: C21H22N4O
IUPAC name: 1-isoquinolin-5-yl-3-[(4-pyrrolidin-1-ylphenyl)methyl]urea
Create Date: 2006-10-25
CID: 10247042

2825. CHEMBL425201; phthalazinone analogue, 9a; SCHEMBL6367272 ...
MW:     359.464100 g/mol MF: C23H25N3O
IUPAC name: 4-[4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]-2H-phthala...
Create Date: 2006-10-25
CID: 10237099

2826. CHEMBL399725; quinazolinone analogue, 1a; SCHEMBL6378266 ...
MW:     345.437520 g/mol MF: C22H23N3O
IUPAC name: 2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-1H-quinaz...
Create Date: 2006-10-25
CID: 10236918

2827. benzimidazole analog., 27; CHEMBL437407; SCHEMBL6479009 ...
MW:     490.593960 g/mol MF: C28H34N4O4
IUPAC name: (5R,7S,8R)-8-[[4-[(2-tert-butylbenzimidazol-1-yl)methyl]benz...
Create Date: 2006-10-25
CID: 10228228

2828. benzimidazole analog., 22; CHEMBL252470; SCHEMBL6788576 ...
MW:     418.488240 g/mol MF: C24H26N4O3
IUPAC name: 4-[(2-cyclopropylbenzimidazol-1-yl)methyl]-N-[(1R,2S)-2-(hyd...
Create Date: 2006-10-25
CID: 10223774

2829. P3 arylpyrrole analog 13; BDBM9132; CHEMBL276081 ...
MW:     755.225490 g/mol MF: C38H42ClF3N6O5
IUPAC name: (2S)-4-[[1-(3-chlorophenyl)pyrrol-3-yl]methyl]-1-[(2S,4R)-2-...
Create Date: 2006-10-25
CID: 10212550

2830. AZD0530 analogue 25; CHEMBL216693; SCHEMBL3203253 ...
MW:     556.053060 g/mol MF: C28H34ClN5O5
IUPAC name: N-(5-chloro-1,3-benzodioxol-4-yl)-7-[3-(4-methylpiperazin-1-...
Create Date: 2006-10-25
CID: 10209627

2831. benzimidazole analog., 19; CHEMBL447787; BDBM26793
MW:     521.608000 g/mol MF: C28H35N5O5
IUPAC name: tert-butyl (3S,4S)-3-(hydroxycarbamoyl)-4-[[4-[(2-propan-2-y...
Create Date: 2006-10-25
CID: 10208262

2832. AZD0530 analogue 16; CHEMBL385563; SCHEMBL3202847 ...
MW:     512.985260 g/mol MF: C26H29ClN4O5
IUPAC name: N-(5-chloro-1,3-benzodioxol-4-yl)-5-(oxan-4-yloxy)-7-(2-pyrr...
Create Date: 2006-10-25
CID: 10207842

2833. benzimidazole analog., 15; CHEMBL402436; BDBM26789
MW:     525.619840 g/mol MF: C26H31N5O5S
IUPAC name: tert-butyl (3S,4S)-3-(hydroxycarbamoyl)-4-[[4-[(2-methylsulf...
Create Date: 2006-10-25
CID: 10186536

2834. benzimidazole analog., 25; CHEMBL404382; SCHEMBL6480002 ...
MW:     476.567380 g/mol MF: C27H32N4O4
IUPAC name: (5R,7S,8R)-N-hydroxy-8-[[4-[(2-propan-2-ylbenzimidazol-1-yl)...
Create Date: 2006-10-25
CID: 10184071

2835. CHEMBL191635; 8-sulfanyladenine; Pent-4-ynyl analogue, 4 ...
MW:     465.311310 g/mol MF: C17H16IN5OS
IUPAC name: 8-(2-iodo-5-methoxyphenyl)sulfanyl-9-pent-4-ynylpurin-6-amin...
Create Date: 2006-10-25
CID: 10183346

2836. AZD0530 analogue 21; CHEMBL262371; SCHEMBL3195124 ...
MW:     542.069540 g/mol MF: C28H36ClN5O4
IUPAC name: N-(2-chloro-5-methoxyphenyl)-7-[3-(4-methylpiperazin-1-yl)pr...
Create Date: 2006-10-25
CID: 10165834

2837. benzimidazole analog., 17; CHEMBL403186; BDBM26791
MW:     493.554840 g/mol MF: C26H31N5O5
IUPAC name: tert-butyl (3S,4S)-3-(hydroxycarbamoyl)-4-[[4-[(2-methylbenz...
Create Date: 2006-10-25
CID: 10163627

2838. benzimidazole analog., 29; CHEMBL404010; SCHEMBL6245645 ...
MW:     436.503520 g/mol MF: C24H28N4O4
IUPAC name: (3R,4R)-N-hydroxy-4-[[4-[(2-propan-2-ylbenzimidazol-1-yl)met...
Create Date: 2006-10-25
CID: 10160197

2839. GW701032X; benzyl amide analog., 11; CHEMBL269985 ...
MW:     413.468420 g/mol MF: C25H23N3O3
IUPAC name: N-[(4-methoxyphenyl)methyl]-4-[2-methyl-5-(5-methyl-1,3,4-ox...
Create Date: 2006-10-25
CID: 10158653

2840. benzyl amide analog., 10; CHEMBL271271; SCHEMBL4854275 ...
MW:     413.468420 g/mol MF: C25H23N3O3
IUPAC name: N-[(3-methoxyphenyl)methyl]-4-[2-methyl-5-(5-methyl-1,3,4-ox...
Create Date: 2006-10-25
CID: 10158652

2841. benzimidazole analog., 23; CHEMBL252480; SCHEMBL6796137 ...
MW:     459.540160 g/mol MF: C26H29N5O3
IUPAC name: (3S,4S)-N-hydroxy-4-[[4-[(2-propan-2-ylbenzimidazol-1-yl)met...
Create Date: 2006-10-25
CID: 10139402

2842. benzimidazole analog., 18; CHEMBL251867; SCHEMBL6789728 ...
MW:     393.439020 g/mol MF: C21H23N5O3
IUPAC name: (3S,4S)-N-hydroxy-4-[[4-[(2-methylbenzimidazol-1-yl)methyl]b...
Create Date: 2006-10-25
CID: 10135184

2843. quinazolinone analogue, 1g; SCHEMBL4339844; BDBM27711 ...
MW:     382.886520 g/mol MF: C21H23ClN4O
IUPAC name: 2-[3-[4-(4-chlorophenyl)piperazin-1-yl]propyl]-1H-quinazolin...
Create Date: 2006-10-25
CID: 10134539

2844. P3 arylpyrrole analog 18; BDBM9137; CHEMBL127589 ...
MW:     755.225490 g/mol MF: C38H42ClF3N6O5
IUPAC name: (2S)-4-[[1-(4-chlorophenyl)pyrrol-3-yl]methyl]-1-[(2S,4R)-2-...
Create Date: 2006-10-25
CID: 10123174

2845. benzimidazole analog., 28; CHEMBL252876; SCHEMBL6491584 ...
MW:     494.557843 g/mol MF: C27H31FN4O4
IUPAC name: (5R,7S,8R)-8-[[4-[[2-(2-fluoropropan-2-yl)benzimidazol-1-yl]...
Create Date: 2006-10-25
CID: 10117481

2846. AZD0530 analogue 23; SCHEMBL3195521; BDBM12245 ...
MW:     398.842860 g/mol MF: C20H19ClN4O3
IUPAC name: N-(5-chloro-1,3-benzodioxol-4-yl)-5-piperidin-4-yloxyquinazo...
Create Date: 2006-10-25
CID: 10111499

2847. piperidinone analogue, 28; CHEMBL162175; BDBM19811 ...
MW:     622.751640 g/mol MF: C34H46N4O7
IUPAC name: benzyl N-methyl-N-[(2S)-4-methyl-1-[4-[[(2S)-4-methyl-2-(phe...
Create Date: 2006-10-25
CID: 10077641

2848. Isoquinoline Analogue, 47; CHEMBL397273; SCHEMBL4023228 ...
MW:     378.442623 g/mol MF: C22H23FN4O
IUPAC name: 1-[(3-fluoro-4-pyrrolidin-1-ylphenyl)methyl]-3-(3-methylisoq...
Create Date: 2006-10-25
CID: 10022547

2849. CHEMBL486901; tacrine-E2020 analog 3; BDBM8979 ...
MW:     456.622340 g/mol MF: C29H36N4O
IUPAC name: N-[2-(1-benzylpiperidin-4-yl)ethyl]-2-(1,2,3,4-tetrahydroacr...
Create Date: 2006-10-25
CID: 10004239

2850. Isoquinoline Analogue, 39; CHEMBL427266; SCHEMBL4024955 ...
MW:     388.505320 g/mol MF: C24H28N4O
IUPAC name: 1-[[4-(azepan-1-yl)phenyl]methyl]-3-(3-methylisoquinolin-5-y...
Create Date: 2006-10-25
CID: 9977590

2851. rapamycin; Rapammune; Rapamune ...
MW:     914.171860 g/mol MF: C51H79NO13
Create Date: 2006-10-25
CID: 9962928

2852. aminothiazole analogue, 57; SCHEMBL4715713; BDBM25713 ...
MW:     298.159020 g/mol MF: C10H8BrN3OS
IUPAC name: 1-(5-bromo-1,3-thiazol-2-yl)-3-phenylurea
Create Date: 2006-10-25
CID: 9948168

2853. CHEMBL186418; quinazolinone analogue, 1f; SCHEMBL424189 ...
MW:     379.882580 g/mol MF: C22H22ClN3O
IUPAC name: 5-chloro-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-...
Create Date: 2006-10-25
CID: 9886153

2854. Dipyridamole Analogue, 76; CHEMBL183236; SCHEMBL3685889 ...
MW:     560.731920 g/mol MF: C28H48N8O4
IUPAC name: 2-N,2-N,6-N,6-N-tetrakis(2-methoxyethyl)-4,8-di(piperidin-1-...
Create Date: 2006-10-25
CID: 9850791

2855. CHEMBL251030; quinazolinone analogue, 1d; SCHEMBL6797445 ...
MW:     397.873043 g/mol MF: C22H21ClFN3O
IUPAC name: 8-chloro-2-[3-[4-(4-fluorophenyl)-3,6-dihydro-2H-pyridin-1-y...
Create Date: 2006-10-25
CID: 9843777

2856. Pyrrolocarbazole Analog 20; CHEMBL221536; SCHEMBL13140090 ...
MW:     328.387080 g/mol MF: C20H12N2OS
Create Date: 2006-10-25
CID: 9840393

2857. RU54115 Analog 7; CHEMBL349704; BDBM10045 ...
MW:     344.510820 g/mol MF: C21H28O2S
IUPAC name: (10R,13S)-13-methyl-10-(2-methylsulfanylethyl)-2,6,7,8,12,14...
Create Date: 2006-10-25
CID: 9819524

2858. 4-(4-ethylpiperazin-1-yl)-N-[6-(3-hydroxyphenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]butanamide; 6-aryl-pyrazolo[3,4-b]pyridine analogue 24; AC1O6ZV6 ...
MW:     408.496720 g/mol MF: C22H28N6O2
IUPAC name: 4-(4-ethylpiperazin-1-yl)-N-[6-(3-hydroxyphenyl)-1H-pyrazolo...
Create Date: 2006-05-10
CID: 6539585

2859. SB-732881; SB-732881-H; 6-aryl-pyrazolo[3,4-b]pyridine analogue 23 ...
MW:     430.298400 g/mol MF: C19H20BrN5O2
IUPAC name: N-[5-bromo-6-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,2-dihydro...
Create Date: 2006-05-10
CID: 6539584

2860. 6-aryl-pyrazolo[3,4-b]pyridine analogue 22; AC1O6ZV2; BDBM8358 ...
MW:     351.402340 g/mol MF: C19H21N5O2
IUPAC name: 1-methyl-N-[6-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,2-dihydr...
Create Date: 2006-05-10
CID: 6539583

2861. N-(5-bromo-6-phenyl-1H-pyrazolo[3,4-b]pyridin-3-yl)-1-methylpiperidine-4-carboxamide; N-{5-bromo-6-phenyl-1H-pyrazolo[3,4-b]pyridin-3-yl}-1-methylpiperidine-4-carboxamide; AC1O6ZUY ...
MW:     414.299000 g/mol MF: C19H20BrN5O
IUPAC name: N-(5-bromo-6-phenyl-1H-pyrazolo[3,4-b]pyridin-3-yl)-1-methyl...
Create Date: 2006-05-10
CID: 6539581

2862. N-(5-cyano-6-phenyl-1H-pyrazolo[3,4-b]pyridin-3-yl)cyclopropanecarboxamide; N-{5-cyano-6-phenyl-1H-pyrazolo[3,4-b]pyridin-3-yl}cyclopropanecarboxamide; AC1O6ZUW ...
MW:     303.318020 g/mol MF: C17H13N5O
IUPAC name: N-(5-cyano-6-phenyl-1H-pyrazolo[3,4-b]pyridin-3-yl)cycloprop...
Create Date: 2006-05-10
CID: 6539580

2863. N-(5-chloro-6-phenyl-1H-pyrazolo[3,4-b]pyridin-3-yl)cyclopropanecarboxamide; N-{5-chloro-6-phenyl-1H-pyrazolo[3,4-b]pyridin-3-yl}cyclopropanecarboxamide; AC1O6ZUU ...
MW:     312.753620 g/mol MF: C16H13ClN4O
IUPAC name: N-(5-chloro-6-phenyl-1H-pyrazolo[3,4-b]pyridin-3-yl)cyclopro...
Create Date: 2006-05-10
CID: 6539579

2864. N-(5,6-diphenyl-1H-pyrazolo[3,4-b]pyridin-3-yl)cyclopropanecarboxamide; N-{5,6-diphenyl-1H-pyrazolo[3,4-b]pyridin-3-yl}cyclopropanecarboxamide; AC1O6ZUQ ...
MW:     354.404520 g/mol MF: C22H18N4O
IUPAC name: N-(5,6-diphenyl-1H-pyrazolo[3,4-b]pyridin-3-yl)cyclopropanec...
Create Date: 2006-05-10
CID: 6539577

2865. AC1O6ZUO; 6-aryl-pyrazolo[3,4-b]pyridine analogue 15; BDBM8351 ...
MW:     308.334540 g/mol MF: C17H16N4O2
IUPAC name: N-[5-methyl-6-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,2-dihydr...
Create Date: 2006-05-10
CID: 6539576

2866. AC1O6ZUM; 6-aryl-pyrazolo[3,4-b]pyridine analogue 14; BDBM8350 ...
MW:     328.753020 g/mol MF: C16H13ClN4O2
IUPAC name: N-[5-chloro-6-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,2-dihydr...
Create Date: 2006-05-10
CID: 6539575

2867. N-[6-(2-methoxyphenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]cyclopropanecarboxamide; AC1O6ZUG; 6-aryl-pyrazolo[3,4-b]pyridine analogue 11 ...
MW:     308.334540 g/mol MF: C17H16N4O2
IUPAC name: N-[6-(2-methoxyphenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]cyclop...
Create Date: 2006-05-10
CID: 6539572

2868. AC1O6ZUE; 6-aryl-pyrazolo[3,4-b]pyridine analogue 10; BDBM8346 ...
MW:     294.307960 g/mol MF: C16H14N4O2
IUPAC name: N-[(6Z)-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyr...
Create Date: 2006-05-10
CID: 6539571

2869. NSC722040; (-)-Isopinocamphene analog; SCHEMBL3755547 ...
MW:     306.529120 g/mol MF: C20H38N2
IUPAC name: N-cyclooctyl-N'-[(1S,3R,4R,5R)-4,6,6-trimethyl-3-bicyclo[3.1...
Create Date: 2006-04-29
CID: 6476772

2870. Chlorobenzodioxole deriv. 27; AC1NS8KE; AZD0530 analogue 34 ...
MW:     456.922000 g/mol MF: C23H25ClN4O4
IUPAC name: N-(5-chloro-1,3-benzodioxol-4-yl)-6-methoxy-7-[(1-methylpipe...
Create Date: 2006-01-30
CID: 5330196

2871. AZM 475271; 476159-98-5; AZM475271 ...
MW:     442.938480 g/mol MF: C23H27ClN4O3
IUPAC name: N-(2-chloro-5-methoxyphenyl)-6-methoxy-7-[(1-methylpiperidin...
Create Date: 2006-01-30
CID: 5330175

2872. AC1NS8HT; 3,4-Dihydro-1,6-naphthyridine analogue 53; BDBM6186 ...
MW:     525.639760 g/mol MF: C28H39N5O5
IUPAC name: N-[2-(tert-butylcarbamoylamino)-3-(3,5-dimethoxyphenyl)-3,4-...
Create Date: 2006-01-30
CID: 5330165

2873. AC1NS8HQ; 3,4-Dihydro-1,6-naphthyridine analogue 52; BDBM6185 ...
MW:     511.613180 g/mol MF: C27H37N5O5
IUPAC name: N-[2-(tert-butylcarbamoylamino)-3-(3,5-dimethoxyphenyl)-3,4-...
Create Date: 2006-01-30
CID: 5330164

2874. AC1NS8HN; 3,4-Dihydro-1,6-naphthyridine analogue 51; BDBM6184 ...
MW:     497.586600 g/mol MF: C26H35N5O5
IUPAC name: N-[2-(tert-butylcarbamoylamino)-3-(3,5-dimethoxyphenyl)-3,4-...
Create Date: 2006-01-30
CID: 5330163

2875. AC1NS8HK; 3,4-Dihydro-1,6-naphthyridine analogue 50; BDBM6183 ...
MW:     615.762300 g/mol MF: C35H45N5O5
IUPAC name: N-[2-(tert-butylcarbamoylamino)-3-(3,5-dimethoxyphenyl)-3,4-...
Create Date: 2006-01-30
CID: 5330162

2876. AC1NS8HH; 3,4-Dihydro-1,6-naphthyridine analogue 49; BDBM6182 ...
MW:     601.735720 g/mol MF: C34H43N5O5
IUPAC name: N-[2-(tert-butylcarbamoylamino)-3-(3,5-dimethoxyphenyl)-3,4-...
Create Date: 2006-01-30
CID: 5330161

2877. AC1NS8HE; 3,4-Dihydro-1,6-naphthyridine analogue 48; BDBM6181 ...
MW:     587.709140 g/mol MF: C33H41N5O5
IUPAC name: N-[2-(tert-butylcarbamoylamino)-3-(3,5-dimethoxyphenyl)-3,4-...
Create Date: 2006-01-30
CID: 5330160

2878. 3-substituted indolin-2-one 11h; SU5402 analog 11h; AC1NS662 ...
MW:     402.442480 g/mol MF: C24H22N2O4
IUPAC name: 3-[5-[(Z)-[6-(4-methoxyphenyl)-2-oxo-1H-indol-3-ylidene]meth...
Create Date: 2006-01-30
CID: 5329145

2879. 3-substituted indolin-2-one 11g; SU5402 analog 11g; AC1NS65Z ...
MW:     402.442480 g/mol MF: C24H22N2O4
IUPAC name: 3-[5-[(Z)-[6-(2-methoxyphenyl)-2-oxo-1H-indol-3-ylidene]meth...
Create Date: 2006-01-30
CID: 5329144

2880. 3-substituted indolin-2-one 11f; SU5402 analog 11f; AC1NS65W ...
MW:     402.442480 g/mol MF: C24H22N2O4
IUPAC name: 3-[5-[(Z)-[6-(3-methoxyphenyl)-2-oxo-1H-indol-3-ylidene]meth...
Create Date: 2006-01-30
CID: 5329143

2881. 3-substituted indolin-2-one 11e; SU5402 analog 11e; AC1NS65T ...
MW:     372.416500 g/mol MF: C23H20N2O3
IUPAC name: 3-[4-methyl-5-[(Z)-(2-oxo-6-phenyl-1H-indol-3-ylidene)methyl...
Create Date: 2006-01-30
CID: 5329142

2882. 3-substituted indolin-2-one 11d; SU5402 analog 11d; AC1NS65Q ...
MW:     326.346520 g/mol MF: C18H18N2O4
IUPAC name: 3-[5-[(Z)-(6-methoxy-2-oxo-1H-indol-3-ylidene)methyl]-4-meth...
Create Date: 2006-01-30
CID: 5329141

2883. 3-substituted indolin-2-one 11c; SU5402 analog 11c; AC1NS65N ...
MW:     375.398980 g/mol MF: C17H17N3O5S
IUPAC name: 3-[4-methyl-5-[(Z)-(2-oxo-5-sulfamoyl-1H-indol-3-ylidene)met...
Create Date: 2006-01-30
CID: 5329140

2884. 3-substituted indolin-2-one 11b; SU5402 analog 11b; AC1NS65K ...
MW:     340.330040 g/mol MF: C18H16N2O5
IUPAC name: (3Z)-3-[[4-(2-carboxyethyl)-3-methyl-1H-pyrrol-2-yl]methylid...
Create Date: 2006-01-30
CID: 5329139

2885. 3-substituted indolin-2-one 11a; SU5402 analog 11a; AC1NS65H ...
MW:     296.320540 g/mol MF: C17H16N2O3
IUPAC name: 3-[4-methyl-5-[(Z)-(2-oxo-1H-indol-3-ylidene)methyl]-1H-pyrr...
Create Date: 2006-01-30
CID: 5329138

2886. AC1NS3IQ; Modified Benzophenone Ring, Balanol Analog 30; BDBM3230 ...
MW:     532.541220 g/mol MF: C29H28N2O8
IUPAC name: [(3R,4R)-4-[(4-hydroxybenzoyl)amino]pyrrolidin-3-yl] 3,5-dih...
Create Date: 2006-01-30
CID: 5327989

2887. AC1NS3IN; Modified Benzophenone Ring, Balanol Analog 29; BDBM3229 ...
MW:     556.562620 g/mol MF: C31H28N2O8
IUPAC name: [(3R,4R)-3-[(4-hydroxybenzoyl)amino]azepan-4-yl] 3,5-dihydro...
Create Date: 2006-01-30
CID: 5327988

2888. AC1NS3IK; Modified Benzophenone Ring, Balanol Analog 28; BDBM3228 ...
MW:     528.509460 g/mol MF: C29H24N2O8
IUPAC name: [(3R,4R)-4-[(4-hydroxybenzoyl)amino]pyrrolidin-3-yl] 3,5-dih...
Create Date: 2006-01-30
CID: 5327987

2889. AC1NS3IH; Modified Benzophenone Ring, Balanol Analog 27; BDBM3227 ...
MW:     556.519560 g/mol MF: C30H24N2O9
IUPAC name: 1-[2,6-dihydroxy-4-[(3R,4R)-4-[(4-hydroxybenzoyl)amino]pyrro...
Create Date: 2006-01-30
CID: 5327986

2890. AC1NS3HW; Modified Benzophenone Ring, Balanol Analog 20; BDBM3220 ...
MW:     507.488700 g/mol MF: C27H25NO9
IUPAC name: 2-[2,6-dihydroxy-4-[[(1R,2R)-2-[(4-hydroxybenzoyl)amino]cycl...
Create Date: 2006-01-30
CID: 5327979

2891. AC1NS3HT; Modified Benzophenone Ring, Balanol Analog 19; BDBM3219 ...
MW:     550.556500 g/mol MF: C29H30N2O9
IUPAC name: [(3R,4R)-3-[(4-hydroxybenzoyl)amino]azepan-4-yl] 4-(2,6-dihy...
Create Date: 2006-01-30
CID: 5327978

2892. AC1NS3HQ; Modified Benzophenone Ring, Balanol Analog 18; BDBM3218 ...
MW:     517.526580 g/mol MF: C29H27NO8
IUPAC name: 3-hydroxy-2-[4-[(1R,2R)-2-[(4-hydroxybenzoyl)amino]cyclopent...
Create Date: 2006-01-30
CID: 5327977

2893. AC1NS3HN; Modified Benzophenone Ring, Balanol Analog 17; BDBM3217 ...
MW:     489.473420 g/mol MF: C27H23NO8
IUPAC name: 3-hydroxy-2-[4-[(1R,2R)-2-[(4-hydroxybenzoyl)amino]cyclopent...
Create Date: 2006-01-30
CID: 5327976

2894. AC1NS3HK; Modified Benzophenone Ring, Balanol Analog 16; BDBM3216 ...
MW:     505.472820 g/mol MF: C27H23NO9
IUPAC name: 3-hydroxy-2-[2-hydroxy-4-[(1R,2R)-2-[(4-hydroxybenzoyl)amino...
Create Date: 2006-01-30
CID: 5327975

2895. AC1NS3HH; Modified Benzophenone Ring, Balanol Analog 15; BDBM3215 ...
MW:     488.445600 g/mol MF: C26H20N2O8
IUPAC name: [(3R,4R)-4-[(4-hydroxybenzoyl)amino]pyrrolidin-3-yl] 4,5-dih...
Create Date: 2006-01-30
CID: 5327974

2896. AC1NS3HE; Modified Benzophenone Ring, Balanol Analog 14; BDBM3214 ...
MW:     532.498160 g/mol MF: C28H24N2O9
IUPAC name: 8-hydroxy-6-[(3R,4R)-3-[(4-hydroxybenzoyl)amino]azepan-4-yl]...
Create Date: 2006-01-30
CID: 5327973

2897. AC1NS3HB; Modified Benzophenone Ring, Balanol Analog 13; BDBM3213 ...
MW:     550.556500 g/mol MF: C29H30N2O9
IUPAC name: [(3R,4R)-3-[(4-hydroxybenzoyl)amino]azepan-4-yl] 4-(2,6-dime...
Create Date: 2006-01-30
CID: 5327972

2898. Modified Benzophenone Ring, Balanol Analog 12; AC1NS3H8; BDBM3212 ...
MW:     522.503340 g/mol MF: C27H26N2O9
IUPAC name: [(3R,4R)-3-[(4-hydroxybenzoyl)amino]azepan-4-yl] 4-(2,6-dihy...
Create Date: 2006-01-30
CID: 5327971

2899. Modified Benzophenone Ring, Balanol Analog 11; AC1NS3H5; BDBM3211 ...
MW:     506.503940 g/mol MF: C27H26N2O8
IUPAC name: [(3R,4R)-3-[(4-hydroxybenzoyl)amino]azepan-4-yl] 3,5-dihydro...
Create Date: 2006-01-30
CID: 5327970

2900. Modified Benzophenone Ring, Balanol Analog 10; AC1NS3H2; BDBM3210 ...
MW:     535.502100 g/mol MF: C27H25N3O9
IUPAC name: 2-[2,6-dihydroxy-4-[(3R,4R)-3-[(4-hydroxybenzoyl)amino]azepa...
Create Date: 2006-01-30
CID: 5327969

2901. AC1NS3GW; Modified Benzophenone Ring, Balanol Analog 8; BDBM3208 ...
MW:     540.561680 g/mol MF: C28H32N2O9
IUPAC name: (1S,2R)-2-[2,6-dihydroxy-4-[(3R,4R)-3-[(4-hydroxybenzoyl)ami...
Create Date: 2006-01-30
CID: 5327967

2902. CHEMBL193697; 10''-Deoxybalanol; 10"-Deoxybalanol, 4 ...
MW:     534.514040 g/mol MF: C28H26N2O9
IUPAC name: 2-[2,6-dihydroxy-4-[(3R,4R)-3-[(4-hydroxybenzoyl)amino]azepa...
Create Date: 2006-01-30
CID: 5327966

2903. calcitriol; Rocaltrol; Calcijex ...
MW:     416.636460 g/mol MF: C27H44O3
IUPAC name: (1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(2R)-6-hydroxy-6-methy...
Create Date: 2004-09-16
CID: 5280453

2904. AC1NQSPS; benzenesulfonamide analog 9; CHEMBL380987 ...
MW:     698.895640 g/mol MF: C34H46N6O6S2
IUPAC name: (2S)-N-[(2S,3R)-4-[(4-formamidophenyl)sulfonyl-(2-methylprop...
Create Date: 2005-10-07
CID: 5278358

2905. AC1NQSPP; benzenesulfonamide analog 8; CHEMBL196663 ...
MW:     670.885540 g/mol MF: C33H46N6O5S2
IUPAC name: (2S)-N-[(2S,3R)-4-[(4-aminophenyl)sulfonyl-(2-methylpropyl)a...
Create Date: 2005-10-07
CID: 5278357

2906. AC1M3ZIB; Rhodanine-furan analogue 6; BDBM8419 ...
MW:     436.503440 g/mol MF: C22H16N2O4S2
IUPAC name: (5Z)-5-[[5-(2-nitrophenyl)furan-2-yl]methylidene]-3-(2-pheny...
Create Date: 2005-07-15
CID: 2247612

2907. ZINC02883137; Benzonitrile analogue, 5f; AC1M3CS8 ...
MW:     288.139300 g/mol MF: C14H10BrNO
IUPAC name: 3-[(4-bromophenyl)methoxy]benzonitrile
Create Date: 2005-07-15
CID: 2235437

2908. N-butyl-4-[(phenylsulfonyl)amino]benzamide; SMR000079780; MLS000066184 ...
MW:     332.417300 g/mol MF: C17H20N2O3S
IUPAC name: 4-(benzenesulfonamido)-N-butylbenzamide
Create Date: 2005-07-15
CID: 2224401

2909. (5Z)-3-(4-methoxyphenyl)-2-sulfanylidene-5-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-1,3-thiazolidin-4-one; (5Z)-3-(4-methoxyphenyl)-2-sulfanylidene-5-[[5-[3-(trifluoromethyl)phenyl]furan-2-yl]methylidene]-1,3-thiazolidin-4-one; AC1LZU7E ...
MW:     461.476670 g/mol MF: C22H14F3NO3S2
IUPAC name: (5Z)-3-(4-methoxyphenyl)-2-sulfanylidene-5-[[5-[3-(trifluoro...
Create Date: 2005-07-13
CID: 1983310

2910. STK805228; (5Z)-5-[[5-(4-chlorophenyl)furan-2-yl]methylidene]-3-(furan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one; (5Z)-5-{[5-(4-chlorophenyl)furan-2-yl]methylidene}-3-(furan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one ...
MW:     401.886480 g/mol MF: C19H12ClNO3S2
IUPAC name: (5Z)-5-[[5-(4-chlorophenyl)furan-2-yl]methylidene]-3-(furan-...
Create Date: 2005-07-13
CID: 1965829

2911. AG-690/36159010; 3-allyl-5-{[5-(4-fluorophenyl)-2-furyl]methylene}-2-thioxo-1,3-thiazolidin-4-one; ZINC02067857 ...
MW:     345.411083 g/mol MF: C17H12FNO2S2
IUPAC name: (5Z)-5-[[5-(4-fluorophenyl)furan-2-yl]methylidene]-3-prop-2-...
Create Date: 2005-07-12
CID: 1730612

2912. 4-[(5Z)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid; 4-[(5Z)-5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid; AC1LUMJ7 ...
MW:     418.443560 g/mol MF: C18H14N2O6S2
IUPAC name: 4-[(5Z)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2...
Create Date: 2005-07-12
CID: 1635073

2913. (5Z)-3-(furan-2-ylmethyl)-5-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one; (5Z)-3-(furan-2-ylmethyl)-5-{[5-(4-nitrophenyl)furan-2-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one; AC1LUHGP ...
MW:     412.438980 g/mol MF: C19H12N2O5S2
IUPAC name: (5Z)-3-(furan-2-ylmethyl)-5-[[5-(4-nitrophenyl)furan-2-yl]me...
Create Date: 2005-07-12
CID: 1606840

2914. F0095-2280; 3-[(5Z)-5-[[5-(2-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid; 3-[(5Z)-5-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid ...
MW:     404.416980 g/mol MF: C17H12N2O6S2
IUPAC name: 3-[(5Z)-5-[[5-(2-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2...
Create Date: 2005-07-11
CID: 1597700

2915. (5Z)-3-(4-hydroxyphenyl)-5-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one; (5Z)-3-(4-hydroxyphenyl)-5-{[5-(4-nitrophenyl)furan-2-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one; Rhodanine-furan analogue 4 ...
MW:     424.449680 g/mol MF: C20H12N2O5S2
IUPAC name: (5Z)-3-(4-hydroxyphenyl)-5-[[5-(4-nitrophenyl)furan-2-yl]met...
Create Date: 2005-07-11
CID: 1594642

2916. N-phenyl-4-[(phenylsulfonyl)amino]benzamide; ST51013557; ZINC01205976 ...
MW:     352.406940 g/mol MF: C19H16N2O3S
IUPAC name: 4-(benzenesulfonamido)-N-phenylbenzamide
Create Date: 2005-07-11
CID: 1362627

2917. STK828409; (5Z)-3-(furan-2-ylmethyl)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one; (5Z)-3-(furan-2-ylmethyl)-5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one ...
MW:     412.438980 g/mol MF: C19H12N2O5S2
IUPAC name: (5Z)-3-(furan-2-ylmethyl)-5-[[5-(3-nitrophenyl)furan-2-yl]me...
Create Date: 2005-07-11
CID: 1360423

2918. 4-{[(4-chlorophenyl)sulfonyl]amino}-N-(1,3-thiazol-2-yl)benzamide; AC1LPRAY; Sulfonamide analogue, 23 ...
MW:     393.867780 g/mol MF: C16H12ClN3O3S2
IUPAC name: 4-[(4-chlorophenyl)sulfonylamino]-N-(1,3-thiazol-2-yl)benzam...
Create Date: 2005-07-11
CID: 1336667

2919. MLS000089130; AC1LPNUS; Sulfonamide analogue, 13 ...
MW:     371.410280 g/mol MF: C18H17N3O4S
IUPAC name: 4-[benzenesulfonyl(methyl)amino]-N-(5-methyl-1,2-oxazol-3-yl...
Create Date: 2005-07-10
CID: 1310191

2920. AC1LPNGB; SMR000072813; Sulfonamide analogue, 24 ...
MW:     373.449300 g/mol MF: C17H15N3O3S2
IUPAC name: 4-[benzenesulfonyl(methyl)amino]-N-(1,3-thiazol-2-yl)benzami...
Create Date: 2005-07-10
CID: 1309992

2921. MLS000089122; AC1LPNDX; Sulfonamide analogue, 12 ...
MW:     402.490520 g/mol MF: C18H18N4O3S2
IUPAC name: 4-[benzenesulfonyl(methyl)amino]-N-(5-ethyl-1,3,4-thiadiazol...
Create Date: 2005-07-10
CID: 1309961

2922. Sulfonamide analogue, 10; AC1LP3M1; MLS000049803 ...
MW:     371.410280 g/mol MF: C18H17N3O4S
IUPAC name: N-(5-methyl-1,2-oxazol-3-yl)-4-[(4-methylphenyl)sulfonylamin...
Create Date: 2005-07-10
CID: 1300581

2923. N-benzyl-4-[(phenylsulfonyl)amino]benzamide; ZINC01049409; AC1LOKT7 ...
MW:     366.433520 g/mol MF: C20H18N2O3S
IUPAC name: 4-(benzenesulfonamido)-N-benzylbenzamide
Create Date: 2005-07-10
CID: 1241968

2924. 4-Benzyloxybenzonitrile; 4-(benzyloxy)benzonitrile; 52805-36-4 ...
MW:     209.243240 g/mol MF: C14H11NO
IUPAC name: 4-phenylmethoxybenzonitrile
Create Date: 2005-03-27
CID: 561371

2925. 3-(Benzyloxy)benzonitrile; 61147-43-1; VLZQTLUSPQUQLC-UHFFFAOYSA-N ...
MW:     209.243240 g/mol MF: C14H11NO
IUPAC name: 3-phenylmethoxybenzonitrile
Create Date: 2005-03-27
CID: 561329

2926. 4'-Methyl fentanyl; AC1LB1LA; Fentanyl para tolyl analog ...
MW:     350.497100 g/mol MF: C23H30N2O
IUPAC name: N-(4-methylphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propan...
Create Date: 2005-03-27
CID: 527013

2927. CHEMBL79236; AC1LARNY; P3 pyridylfuran analog 2 ...
MW:     723.781070 g/mol MF: C38H44F3N5O6
IUPAC name: (2S)-1-[(2S,4R)-4-benzyl-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4...
Create Date: 2005-08-01
CID: 493830

2928. AC1LAQ4V; (S)-PMPO-DAPy; Analog of (S)-PMPDAP ...
MW:     278.202262 g/mol MF: C8H15N4O5P
IUPAC name: [(2S)-1-(2,6-diaminopyrimidin-4-yl)oxypropan-2-yl]oxymethylp...
Create Date: 2005-08-01
CID: 493061

2929. AC1LAQ4S; (R)-PMPO-DAPy; Analog of (R)-PMPDAP ...
MW:     278.202262 g/mol MF: C8H15N4O5P
IUPAC name: [(2R)-1-(2,6-diaminopyrimidin-4-yl)oxypropan-2-yl]oxymethylp...
Create Date: 2005-08-01
CID: 493060

2930. methyl 2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl]benzimidazole-4-carboxylate; AC1LAPCA; benzimidazole analogue, 50 ...
MW:     414.352373 g/mol MF: C22H14F4N2O2
IUPAC name: methyl 2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl]...
Create Date: 2005-08-01
CID: 492679

2931. AC1LAPC7; benzimidazole analogue, 59; CHEMBL244144 ...
MW:     399.384093 g/mol MF: C22H17F4N3
IUPAC name: 2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl]-N,N-di...
Create Date: 2005-08-01
CID: 492678

2932. CHEMBL294604; AC1LAPC4; benzimidazole analogue, 58 ...
MW:     385.357513 g/mol MF: C21H15F4N3
IUPAC name: 2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl]-N-meth...
Create Date: 2005-08-01
CID: 492677

2933. CHEMBL58358; N-[2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl]benzimidazol-4-yl]acetamide; AC1LAPC1 ...
MW:     413.367613 g/mol MF: C22H15F4N3O
IUPAC name: N-[2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl]benz...
Create Date: 2005-08-01
CID: 492676

2934. CHEMBL293984; 2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl]benzimidazol-4-amine; AC1LAPBY ...
MW:     371.330933 g/mol MF: C20H13F4N3
IUPAC name: 2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl]benzimi...
Create Date: 2005-08-01
CID: 492675

2935. CHEMBL418637; AC1LAPBV; benzimidazole analogue, 47 ...
MW:     384.369453 g/mol MF: C22H16F4N2
IUPAC name: 2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl]-4-ethy...
Create Date: 2005-08-01
CID: 492674

2936. CHEMBL58494; AC1LAPBS; benzimidazole analogue, 57 ...
MW:     427.394193 g/mol MF: C23H17F4N3O
IUPAC name: N-[2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl]benz...
Create Date: 2005-08-01
CID: 492673

2937. CHEMBL292923; AC1LAPBP; benzimidazole analogue, 44 ...
MW:     386.342273 g/mol MF: C21H14F4N2O
IUPAC name: 2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl]-4-meth...
Create Date: 2005-08-01
CID: 492672

2938. CHEMBL58268; AC1LAPBJ; benzimidazole analogue, 48 ...
MW:     401.313853 g/mol MF: C20H11F4N3O2
IUPAC name: 2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl]-4-nitr...
Create Date: 2005-08-01
CID: 492670

2939. CHEMBL291505; 4-chloro-2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl]benzimidazole; AC1LAPBA ...
MW:     390.761353 g/mol MF: C20H11ClF4N2
IUPAC name: 4-chloro-2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methy...
Create Date: 2005-08-01
CID: 492667

2940. CHEMBL61352; 4-bromo-2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl]benzimidazole; AC1LAPB4 ...
MW:     435.212353 g/mol MF: C20H11BrF4N2
IUPAC name: 4-bromo-2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl...
Create Date: 2005-08-01
CID: 492665

2941. [2-[(2,6-diaminopurin-9-yl)methyl]-2-(hydroxymethyl)cyclopropyl]methanol; AC1LAIP9; 2,6-Diaminopurine analog ...
MW:     264.283740 g/mol MF: C11H16N6O2
IUPAC name: [2-[(2,6-diaminopurin-9-yl)methyl]-2-(hydroxymethyl)cyclopro...
Create Date: 2005-08-01
CID: 469176

2942. CHEMBL2114261; Ro 31-8959 c-HexCONH analog, trans isomer; AC1LA6S1 ...
MW:     594.741540 g/mol MF: C33H46N4O6
IUPAC name: benzyl N-[(2S)-4-amino-1-[[(2S,3R)-4-[(1S,2R)-2-(tert-butylc...
Create Date: 2005-08-01
CID: 462757

2943. 6-phenethylpteridine-2,4-diamine; 10-deazaaminopterin analog; AC1L9V1E ...
MW:     266.301160 g/mol MF: C14H14N6
IUPAC name: 6-(2-phenylethyl)pteridine-2,4-diamine
Create Date: 2005-08-01
CID: 456508

2944. AC1L9TVQ; Haloperidol Piperid analog; 4-[4-(4-Chlorophenyl)-4-hydroxypiperidino]-4'-piperidinobutyrophenone ...
MW:     441.005420 g/mol MF: C26H33ClN2O2
IUPAC name: 4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-1-(4-piperidi...
Create Date: 2005-08-01
CID: 455920

2945. AC1L9RXU; Pterocarpan 7COOMe analog; ghl.PD_Mitscher_leg0.215 ...
MW:     298.290060 g/mol MF: C17H14O5
IUPAC name: methyl 8-hydroxy-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chrome...
Create Date: 2005-08-01
CID: 454896

2946. 147920-13-6; 1-[[5-(Methylsulfonyloxy)-2-indolyl]carbonyl]-4-[3-(isopropylamino)-2-pyridinyl]piperazine; 1-((5-(Methylsulfonyloxy)-2-indolyl)carbonyl)-4-(3-(isopropylamino)-2-pyridinyl)piperazine ...
MW:     457.545880 g/mol MF: C22H27N5O4S
IUPAC name: [2-[4-[3-(propan-2-ylamino)pyridin-2-yl]piperazine-1-carbony...
Create Date: 2005-08-01
CID: 454728

2947. 147920-12-5; 1-[(6-Cyano-2-indolyl)carbonyl]-4-[3-(isopropylamino)-2-pyridinyl]piperazine; 1-((6-Cyano-2-indolyl)carbonyl)-4-(3-(isopropylamino)-2-pyridinyl)piperazine ...
MW:     388.465560 g/mol MF: C22H24N6O
IUPAC name: 2-[4-[3-(propan-2-ylamino)pyridin-2-yl]piperazine-1-carbonyl...
Create Date: 2005-08-01
CID: 454726

2948. 136816-96-1; Piperazine, 1-(3-(ethylamino)-2-pyridinyl)-4-((5-hydroxy-1H-indol-2-yl)carbonyl)-; 1-(3-(Ethylamino)-2-pyridinyl)-4-((5-hydroxy-2-indolyl)carbonyl)piperazine ...
MW:     365.428920 g/mol MF: C20H23N5O2
IUPAC name: [4-[3-(ethylamino)pyridin-2-yl]piperazin-1-yl]-(5-hydroxy-1H...
Create Date: 2005-08-01
CID: 454723

2949. 136226-17-0; Carbamic acid, (4-(methyl(phenylmethyl)amino)-2,3,4-trioxo-1-(phenylmethyl)butyl)-, phenylmethyl ester; Carbamic acid, [4-[methyl(phenylmethyl)amino]-2,3,4-trioxo-1-(phenylmethyl)butyl]-, phenylmethyl ester ...
MW:     458.505740 g/mol MF: C27H26N2O5
IUPAC name: benzyl N-[(2S)-5-[benzyl(methyl)amino]-3,4,5-trioxo-1-phenyl...
Create Date: 2005-08-01
CID: 454622

2950. Dupont XA259; XA 259; 147528-08-3 ...
MW:     346.379220 g/mol MF: C21H18N2O3
IUPAC name: benzyl 2-[(5S)-6-oxo-5,7-dihydropyrrolo[1,2-d][1,4]benzodiaz...
Create Date: 2005-08-01
CID: 451678

2951. CHEMBL401843; 2-{3-[4-(4-FLUOROPHENYL)-3,6-DIHYDRO-1(2H)-PYRIDINYL]PROPYL}-8-METHYL-4(3H)-QUINAZOLINONE; FRM ...
MW:     377.454563 g/mol MF: C23H24FN3O
IUPAC name: 2-[3-[4-(4-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]propyl]...
Create Date: 2005-06-24
CID: 448889

2952. 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis(dimethylamino)pyrimido[5,4-d]pyrimidin-6-yl]-(2-hydroxyethyl)amino]ethanol; 29491-68-7; NSC516473 ...
MW:     424.497880 g/mol MF: C18H32N8O4
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis(dimethylamino)pyrim...
Create Date: 2005-03-26
CID: 350887

2953. 16908-48-8; 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis(diethylamino)pyrimido[5,4-d]pyrimidin-6-yl]-(2-hydroxyethyl)amino]ethanol; NSC516472 ...
MW:     480.604200 g/mol MF: C22H40N8O4
IUPAC name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis(diethylamino)pyrimi...
Create Date: 2005-03-26
CID: 350886

2954. NSC516424; AC1Q4YNG; Dipyridamole Analogue, 70 ...
MW:     548.636640 g/mol MF: C28H36N8O4
IUPAC name: 2-[[4,8-bis(benzylamino)-2-[bis(2-hydroxyethyl)amino]pyrimid...
Create Date: 2005-03-26
CID: 350875

2955. 68030-12-6; NSC515783; Dipyridamole Analogue, 73 ...
MW:     468.595040 g/mol MF: C24H36N8O2
IUPAC name: 4-[2-morpholin-4-yl-4,8-di(piperidin-1-yl)pyrimido[5,4-d]pyr...
Create Date: 2005-03-26
CID: 350809

2956. 13120-27-9; 2-[[4,8-diamino-2-[bis(2-hydroxyethyl)amino]pyrimido[5,4-d]pyrimidin-6-yl]-(2-hydroxyethyl)amino]ethanol; NSC515178 ...
MW:     368.391560 g/mol MF: C14H24N8O4
IUPAC name: 2-[[4,8-diamino-2-[bis(2-hydroxyethyl)amino]pyrimido[5,4-d]p...
Create Date: 2005-03-26
CID: 350692

2957. 2-ACETAMIDO-5-BROMOTHIAZOLE; 7336-54-1; N-(5-bromothiazol-2-yl)acetamide ...
MW:     221.075000 g/mol MF: C5H5BrN2OS
IUPAC name: N-(5-bromo-1,3-thiazol-2-yl)acetamide
Create Date: 2005-03-26
CID: 350260

2958. NSC71895; 8-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)disulfanyl]-1,3-dimethyl-7H-purine-2,6-dione; Benzimidole disulfide analog ...
MW:     422.442160 g/mol MF: C14H14N8O4S2
IUPAC name: 8-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)disulfanyl]-1,3-dim...
Create Date: 2005-03-26
CID: 251483

2959. 5-bromothiazol-2-amine; 3034-22-8; 2-Amino-5-bromothiazole ...
MW:     179.038320 g/mol MF: C3H3BrN2S
IUPAC name: 5-bromo-1,3-thiazol-2-amine
Create Date: 2005-03-26
CID: 43600

2960. Fenoxon sulfoxide; Fenthion oxon sulfoxide; Bayer 35681 ...
MW:     278.261862 g/mol MF: C10H15O5PS
IUPAC name: dimethyl (3-methyl-4-methylsulfinylphenyl) phosphate
Create Date: 2005-03-27
CID: 23047

2961. Demeton sulfone; Isodemeton-sulfone; PO systox sulfone ...
MW:     290.337222 g/mol MF: C8H19O5PS2
IUPAC name: 1-diethoxyphosphorylsulfanyl-2-ethylsulfonylethane
Create Date: 2005-03-27
CID: 17239

2962. CHEMBL49354; 2-{2,6-dihydroxy-4-[({3-[(4-hydroxybenzoyl)amino]azepan-4-yl}oxy)carbonyl]benzoyl}-3-hydroxybenzoic acid; AC1L1DCL ...
MW:     550.513440 g/mol MF: C28H26N2O10
IUPAC name: 2-[2,6-dihydroxy-4-[3-[(4-hydroxybenzoyl)amino]azepan-4-yl]o...
Create Date: 2005-03-25
CID: 2290

2963. AppppA analog, 5 (X=S); BDBM81575
MW:     813.567606 g/mol MF: C22H28N10O14P3S2-3
IUPAC name: (2R,3R,4S)-2-(6-aminopurin-9-yl)-5-[[[[[(2R,3S,4R)-5-(6-amin...
Create Date: 2015-10-06
CID: 91898375

2964. AppppA analog, 5 (X=O); BDBM81574
MW:     781.436406 g/mol MF: C22H28N10O16P3-3
IUPAC name: [[[(2R,3S,4R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl...
Create Date: 2015-10-06
CID: 91898373

2965. Tertiary Amide Analog, 54; BDBM20712; sodium (3R,5R)-7-[1-(4-fluorophenyl)-3-[(3-phenylpiperidin-1-yl)carbonyl]-4-(propan-2-yl)-1H-pyrazol-5-yl]-3,5-dihydroxyheptanoate
MW:     550.640983 g/mol MF: C31H37FN3O5-
IUPAC name: (3R,5R)-7-[2-(4-fluorophenyl)-5-(3-phenylpiperidine-1-carbon...
Create Date: 2015-10-06
CID: 91895933

2966. benzenesulfonamide analog 23; BDBM12213; (2S)-N-[(2S,3R)-3-hydroxy-4-({3-[(1E)-(hydroxyimino)methyl]benzene}(2-methylpropyl)sulfonamido)-1-phenylbutan-2-yl]-3-methyl-2-{3-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-oxoimidazolidin-1-yl}butanamide
MW:     698.895640 g/mol MF: C34H46N6O6S2
IUPAC name: (2S)-N-[(2S,3R)-3-hydroxy-4-[2-methylpropyl-[3-(nitrosomethy...
Create Date: 2015-10-06
CID: 91895865

2967. AppppA analog, 6 (X=O); BDBM81577
MW:     748.489824 g/mol MF: C23H30N10O15P2-2
IUPAC name: [3-[[(2R,3S,4R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-...
Create Date: 2015-03-23
CID: 91663441

2968. benzenesulfonamide analog 20; BDBM12210; (2S)-N-[(2S,3R)-3-hydroxy-4-({4-[(1E)-(hydroxyimino)methyl]benzene}(2-methylpropyl)sulfonamido)-1-phenylbutan-2-yl]-3-methyl-2-{3-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-oxoimidazolidin-1-yl}butanamide
MW:     698.895640 g/mol MF: C34H46N6O6S2
IUPAC name: (2S)-N-[(2S,3R)-3-hydroxy-4-[2-methylpropyl-[4-(nitrosomethy...
Create Date: 2015-03-17
CID: 91309448

2969. AppppA analog, 9 (X=S); BDBM81580
MW:     764.621624 g/mol MF: C23H30N10O12P2S2-2
IUPAC name: 2-(6-aminopurin-9-yl)-5-[[3-[[5-(6-aminopurin-9-yl)-3,4-dihy...
Create Date: 2014-07-24
CID: 76156233

2970. AppppA analog, 8 (X=S); BDBM81579
MW:     779.636264 g/mol MF: C23H31N11O12P2S2-2
IUPAC name: 2-[[[2-amino-3-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2...
Create Date: 2014-07-24
CID: 76156231

2971. AppppA analog, 7 (X=S); BDBM81578
MW:     778.648204 g/mol MF: C24H32N10O12P2S2-2
IUPAC name: 2-(6-aminopurin-9-yl)-5-[[[3-[[5-(6-aminopurin-9-yl)-3,4-dih...
Create Date: 2014-07-24
CID: 76156229

2972. AppppA analog, 6 (X=S); BDBM81576
MW:     780.621024 g/mol MF: C23H30N10O13P2S2-2
IUPAC name: 2-(6-aminopurin-9-yl)-5-[[[3-[[5-(6-aminopurin-9-yl)-3,4-dih...
Create Date: 2014-07-24
CID: 76156227

2973. AppppA analog, 4 (X=S); BDBM81573
MW:     810.647004 g/mol MF: C24H32N10O14P2S2-2
IUPAC name: 2-(6-aminopurin-9-yl)-5-[[[4-[[5-(6-aminopurin-9-yl)-3,4-dih...
Create Date: 2014-07-24
CID: 76156223

2974. AppppA analog, 3 (X=S); BDBM81572
MW:     836.598164 g/mol MF: C24H26N10O16P2S2-4
IUPAC name: 2,3-bis[[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]met...
Create Date: 2014-07-24
CID: 76156222

2975. AppppA analog, 2 (X=S); BDBM81571
MW:     750.595044 g/mol MF: C22H28N10O12P2S2-2
IUPAC name: 2-(6-aminopurin-9-yl)-5-[[2-[[5-(6-aminopurin-9-yl)-3,4-dihy...
Create Date: 2014-07-24
CID: 76156220

2976. lysine sulfonamide analogue 8; BDBM10144
MW:     558.689520 g/mol MF: C28H38N4O6S
IUPAC name: methyl 3-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]...
Create Date: 2014-01-18
CID: 72699198

2977. Quinapril Cyclohexyl Analogue; ZINC77312742; (3S)-2-[(2S)-2-[[(1S)-1-(Ethoxycarbonyl)-3-cyclohexylpropyl]amino]-1-oxopropyl]-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic Acid
MW:     444.563740 g/mol MF: C25H36N2O5
IUPAC name: (3R)-2-[(2S)-2-[[(2S)-4-cyclohexyl-1-ethoxy-1-oxobutan-2-yl]...
Create Date: 2013-11-01
CID: 71751932

2978. Tertiary Amide Analog, 46; BDBM20704; sodium (3R,5R)-7-[1-(4-fluorophenyl)-3-{[(3-fluorophenyl)methyl](methyl)carbamoyl}-4-(propan-2-yl)-1H-pyrazol-5-yl]-3,5-dihydroxyheptanoate
MW:     528.567586 g/mol MF: C28H32F2N3O5-
IUPAC name: (3R,5R)-7-[2-(4-fluorophenyl)-5-[(3-fluorophenyl)methyl-meth...
Create Date: 2012-08-20
CID: 59832060

2979. Tertiary Amide Analog, 53; BDBM20711; sodium (3R,5R)-7-[1-(4-fluorophenyl)-3-[(2-phenylpiperidin-1-yl)carbonyl]-4-(propan-2-yl)-1H-pyrazol-5-yl]-3,5-dihydroxyheptanoate
MW:     550.640983 g/mol MF: C31H37FN3O5-
IUPAC name: (3R,5R)-7-[2-(4-fluorophenyl)-5-(2-phenylpiperidine-1-carbon...
Create Date: 2012-08-20
CID: 59832053

2980. Tertiary Amide Analog, 55; BDBM20713; sodium (3R,5R)-7-[1-(4-fluorophenyl)-3-{[(3R)-3-phenylpiperidin-1-yl]carbonyl}-4-(propan-2-yl)-1H-pyrazol-5-yl]-3,5-dihydroxyheptanoate
MW:     550.640983 g/mol MF: C31H37FN3O5-
IUPAC name: (3R,5R)-7-[2-(4-fluorophenyl)-5-[(3R)-3-phenylpiperidine-1-c...
Create Date: 2012-08-20
CID: 59832049

2981. Tertiary Amide Analog, 49; BDBM20707; sodium (3R,5R)-7-(3-{[(2,3-difluorophenyl)methyl](methyl)carbamoyl}-1-(4-fluorophenyl)-4-(propan-2-yl)-1H-pyrazol-5-yl)-3,5-dihydroxyheptanoate
MW:     546.558050 g/mol MF: C28H31F3N3O5-
IUPAC name: (3R,5R)-7-[5-[(2,3-difluorophenyl)methyl-methylcarbamoyl]-2-...
Create Date: 2012-08-20
CID: 59832042

2982. Tertiary Amide Analog, 32; BDBM20699; sodium (3R,5R)-7-[1-(4-fluorophenyl)-3-{methyl[(2-methylphenyl)methyl]carbamoyl}-4-(propan-2-yl)-1H-pyrazol-5-yl]-3,5-dihydroxyheptanoate
MW:     524.603703 g/mol MF: C29H35FN3O5-
IUPAC name: (3R,5R)-7-[2-(4-fluorophenyl)-5-[methyl-[(2-methylphenyl)met...
Create Date: 2012-08-20
CID: 59832009

2983. Tertiary Amide Analog, 39; BDBM20696; sodium (3R,5R)-7-{3-[benzyl(methyl)carbamoyl]-1-(4-fluorophenyl)-4-(propan-2-yl)-1H-pyrazol-5-yl}-3,5-dihydroxyheptanoate
MW:     510.577123 g/mol MF: C28H33FN3O5-
IUPAC name: (3R,5R)-7-[5-[benzyl(methyl)carbamoyl]-2-(4-fluorophenyl)-4-...
Create Date: 2012-08-20
CID: 59832008

2984. Tertiary Amide Analog, 51; BDBM20709; sodium (3R,5R)-7-[1-(4-fluorophenyl)-3-{methyl[(1S)-1-phenylethyl]carbamoyl}-4-(propan-2-yl)-1H-pyrazol-5-yl]-3,5-dihydroxyheptanoate
MW:     524.603703 g/mol MF: C29H35FN3O5-
IUPAC name: (3R,5R)-7-[2-(4-fluorophenyl)-5-[methyl-[(1S)-1-phenylethyl]...
Create Date: 2012-08-20
CID: 59832006

2985. Tertiary Amide Analog, 48; BDBM20706; sodium (3R,5R)-7-(3-{[(2,4-difluorophenyl)methyl](methyl)carbamoyl}-1-(4-fluorophenyl)-4-(propan-2-yl)-1H-pyrazol-5-yl)-3,5-dihydroxyheptanoate
MW:     546.558050 g/mol MF: C28H31F3N3O5-
IUPAC name: (3R,5R)-7-[5-[(2,4-difluorophenyl)methyl-methylcarbamoyl]-2-...
Create Date: 2012-08-20
CID: 59831987

2986. Tertiary Amide Analog, 47; BDBM20705; sodium (3R,5R)-7-[1-(4-fluorophenyl)-3-{[(4-fluorophenyl)methyl](methyl)carbamoyl}-4-(propan-2-yl)-1H-pyrazol-5-yl]-3,5-dihydroxyheptanoate
MW:     528.567586 g/mol MF: C28H32F2N3O5-
IUPAC name: (3R,5R)-7-[2-(4-fluorophenyl)-5-[(4-fluorophenyl)methyl-meth...
Create Date: 2012-08-20
CID: 59831977

2987. Tertiary Amide Analog, 45; BDBM20703; sodium (3R,5R)-7-[1-(4-fluorophenyl)-3-{[(2-fluorophenyl)methyl](methyl)carbamoyl}-4-(propan-2-yl)-1H-pyrazol-5-yl]-3,5-dihydroxyheptanoate
MW:     528.567586 g/mol MF: C28H32F2N3O5-
IUPAC name: (3R,5R)-7-[2-(4-fluorophenyl)-5-[(2-fluorophenyl)methyl-meth...
Create Date: 2012-08-20
CID: 59831966

2988. Tertiary Amide Analog, 44; BDBM20702; sodium (3R,5R)-7-[1-(4-fluorophenyl)-3-{[(4-methoxyphenyl)methyl](methyl)carbamoyl}-4-(propan-2-yl)-1H-pyrazol-5-yl]-3,5-dihydroxyheptanoate
MW:     540.603103 g/mol MF: C29H35FN3O6-
IUPAC name: (3R,5R)-7-[2-(4-fluorophenyl)-5-[(4-methoxyphenyl)methyl-met...
Create Date: 2012-08-20
CID: 59831965

2989. Tertiary Amide Analog, 43; BDBM20701; sodium (3R,5R)-7-[1-(4-fluorophenyl)-3-{methyl[(4-methylphenyl)methyl]carbamoyl}-4-(propan-2-yl)-1H-pyrazol-5-yl]-3,5-dihydroxyheptanoate
MW:     524.603703 g/mol MF: C29H35FN3O5-
IUPAC name: (3R,5R)-7-[2-(4-fluorophenyl)-5-[methyl-[(4-methylphenyl)met...
Create Date: 2012-08-20
CID: 59831964

2990. Tertiary Amide Analog, 42; BDBM20700; sodium (3R,5R)-7-[1-(4-fluorophenyl)-3-{methyl[(3-methylphenyl)methyl]carbamoyl}-4-(propan-2-yl)-1H-pyrazol-5-yl]-3,5-dihydroxyheptanoate
MW:     524.603703 g/mol MF: C29H35FN3O5-
IUPAC name: (3R,5R)-7-[2-(4-fluorophenyl)-5-[methyl-[(3-methylphenyl)met...
Create Date: 2012-08-20
CID: 59831961

2991. Tertiary Amide Analog, 41; BDBM20698; sodium (3R,5R)-7-{3-[benzyl(propan-2-yl)carbamoyl]-1-(4-fluorophenyl)-4-(propan-2-yl)-1H-pyrazol-5-yl}-3,5-dihydroxyheptanoate
MW:     538.630283 g/mol MF: C30H37FN3O5-
IUPAC name: (3R,5R)-7-[5-[benzyl(propan-2-yl)carbamoyl]-2-(4-fluoropheny...
Create Date: 2012-08-20
CID: 59831948

2992. Tertiary Amide Analog, 52; BDBM20710; sodium (3R,5R)-7-[1-(4-fluorophenyl)-3-[(2-phenylpyrrolidin-1-yl)carbonyl]-4-(propan-2-yl)-1H-pyrazol-5-yl]-3,5-dihydroxyheptanoate
MW:     536.614403 g/mol MF: C30H35FN3O5-
IUPAC name: (3R,5R)-7-[2-(4-fluorophenyl)-5-(2-phenylpyrrolidine-1-carbo...
Create Date: 2012-08-20
CID: 59831934

2993. Tertiary Amide Analog, 40; BDBM20697; sodium (3R,5R)-7-{3-[benzyl(ethyl)carbamoyl]-1-(4-fluorophenyl)-4-(propan-2-yl)-1H-pyrazol-5-yl}-3,5-dihydroxyheptanoate
MW:     524.603703 g/mol MF: C29H35FN3O5-
IUPAC name: (3R,5R)-7-[5-[benzyl(ethyl)carbamoyl]-2-(4-fluorophenyl)-4-p...
Create Date: 2012-08-20
CID: 59831927

2994. AB-001; UNII-H657DIA015; H657DIA015 ...
MW:     349.509040 g/mol MF: C24H31NO
IUPAC name: 1-adamantyl-(1-pentylindol-3-yl)methanone
Create Date: 2012-07-26
CID: 57404070

2995. Phthalonitrile analogue, 4h; CHEMBL2204752; BDBM86779 ...
MW:     313.148760 g/mol MF: C15H9BrN2O
IUPAC name: 4-[(4-bromophenyl)methoxy]benzene-1,2-dicarbonitrile
Create Date: 2012-07-07
CID: 57340731

2996. Phthalonitrile analogue, 4e; CHEMBL3398534; BDBM86776
MW:     260.289980 g/mol MF: C17H12N2O
IUPAC name: 4-[(E)-3-phenylprop-2-enoxy]benzene-1,2-dicarbonitrile
Create Date: 2012-07-07
CID: 57340730

2997. AppppA analog, 1 (X=O); BDBM81570
MW:     832.355208 g/mol MF: C20H24N10O19P4-4
IUPAC name: [[(2R,3S,4R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]...
Create Date: 2011-12-15
CID: 54592216

2998. Piperazin-1-ium analog, 7; BDBM86555; (1S)-1-(2-Fluorophenyl)-2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]ethanol
MW:     315.405063 g/mol MF: C19H24FN2O+
IUPAC name: (1S)-1-(2-fluorophenyl)-2-[4-(3-methylphenyl)piperazin-1-ium...
Create Date: 2011-09-06
CID: 53350238

2999. Piperidin-1-ium analog, 4; BDBM86552; (1S)-2-[4-(1,2-Benzothiazol-3-yl)piperazin-1-ium-1-yl]-1-thiophen-2-ylethanol
MW:     346.490200 g/mol MF: C17H20N3OS2+
IUPAC name: (1S)-2-[4-(1,2-benzothiazol-3-yl)piperazin-1-ium-1-yl]-1-thi...
Create Date: 2011-09-06
CID: 53350236

3000. Rapamycin C-7, analog 7b; BDBM36615
MW:     957.196600 g/mol MF: C52H80N2O14
Create Date: 2011-04-25
CID: 51049455

3001. 2r4f; Tertiary Amide Analog, 50; GTPL3008 ...
MW:     524.603703 g/mol MF: C29H35FN3O5-
IUPAC name: (3R,5R)-7-[2-(4-fluorophenyl)-5-[methyl-[(1R)-1-phenylethyl]...
Create Date: 2010-03-01
CID: 44629556

3002. glutaminyl adenylate analogue
MW:     597.372101 g/mol MF: C17H24F3N7NaO10P
IUPAC name: sodium;(5-amino-2-azaniumyl-5-oxopentyl) [5-(6-aminopurin-9-...
Create Date: 2009-11-20
CID: 44460408

3003. sst4-selective analogue 23; BDBM50136761; CID44368488 ...
MW:    1033.202980 g/mol MF: C48H62N11O11S2-
IUPAC name: (4S,8R,11R,14S,17R,20S,23R,26S)-26-amino-14-(4-aminobutyl)-2...
Create Date: 2009-11-19
CID: 44368488

3004. sst4-selective analogue 19; BDBM50136760; CID44368421 ...
MW:    1123.282460 g/mol MF: C54H64N11O12S2-
IUPAC name: (4S,7S,10S,13S,17R,20R,23S,26R,29S)-29-amino-7,23,26-tribenz...
Create Date: 2009-11-19
CID: 44368421

3005. sst4-selective analogue 21; BDBM50136766; CID44368405 ...
MW:    1022.178580 g/mol MF: C50H57N10O10S2-
IUPAC name: (4S,7S,10S,14R,17R,20S,23R,26S)-26-amino-7,20,23-tribenzyl-4...
Create Date: 2009-11-19
CID: 44368405

3006. sst4-selective analogue 17; BDBM50136764; CID44368108 ...
MW:    1109.255880 g/mol MF: C53H62N11O12S2-
IUPAC name: (4S,7S,10S,13S,17R,20R,23S,26R,29S)-29-amino-7,23,26-tribenz...
Create Date: 2009-11-19
CID: 44368108

3007. Rapamycin C-7, analog 7a; CHEMBL216404; BDBM36614
MW:     957.196600 g/mol MF: C52H80N2O14
Create Date: 2009-11-19
CID: 44280039

3008. naphthyridinone analog., 27; CHEMBL467661; SCHEMBL14971415 ...
MW:     214.580963 g/mol MF: C8H4ClFN2O2
IUPAC name: 5-chloro-6-fluoro-3-hydroxy-1H-1,8-naphthyridin-2-one
Create Date: 2009-07-27
CID: 44128604

3009. Piperidin-1-ium analog, 2; BDBM86550; Methyl 3-[[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]methyl]furan-2-carboxylate
MW:     339.408220 g/mol MF: C20H23N2O3+
IUPAC name: methyl 3-[[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]methyl]fura...
Create Date: 2009-05-30
CID: 40114645

3010. Piperidin-1-ium analog, 5; BDBM86553; ZINC19802469 ...
MW:     327.440580 g/mol MF: C20H27N2O2+
IUPAC name: 2-[4-[2-(2-phenylphenoxy)ethyl]piperazin-4-ium-1-yl]ethanol
Create Date: 2009-05-28
CID: 28364960

3011. 2-aminopyridine analogue, 9; CHEMBL462624; BDBM28030 ...
MW:     468.840006 g/mol MF: C23H15ClF2N4O3
IUPAC name: N-[4-(2-amino-3-chloropyridin-4-yl)oxy-3-fluorophenyl]-1-(4-...
Create Date: 2009-04-13
CID: 25218744

3012. 2-aminopyridine analogue, 8; CHEMBL462623; BDBM28029 ...
MW:     476.474686 g/mol MF: C26H22F2N4O3
IUPAC name: N-[4-(2-amino-3-propan-2-ylpyridin-4-yl)oxy-3-fluorophenyl]-...
Create Date: 2009-04-13
CID: 25218743

3013. 2-aminopyridine analogue, 7; CHEMBL462622; BDBM28028 ...
MW:     458.416346 g/mol MF: C25H16F2N4O3
IUPAC name: N-[4-(2-amino-3-ethynylpyridin-4-yl)oxy-3-fluorophenyl]-1-(4...
Create Date: 2009-04-13
CID: 25218742

3014. 2-aminopyridine analogue, 6; CHEMBL517293; SCHEMBL1137343 ...
MW:     464.420926 g/mol MF: C24H18F2N4O4
IUPAC name: N-[4-[2-amino-3-(hydroxymethyl)pyridin-4-yl]oxy-3-fluorophen...
Create Date: 2009-04-13
CID: 25218741

3015. 2-aminopyridine analogue, 5; CHEMBL518656; BDBM28026 ...
MW:     488.442326 g/mol MF: C26H18F2N4O4
IUPAC name: N-[4-[2-amino-3-(3-hydroxyprop-1-ynyl)pyridin-4-yl]oxy-3-flu...
Create Date: 2009-04-13
CID: 25218740

3016. 2-aminopyridine analogue, 4; CHEMBL460502; SCHEMBL1137714 ...
MW:     487.457566 g/mol MF: C26H19F2N5O3
IUPAC name: N-[4-[2-amino-3-(3-aminoprop-1-ynyl)pyridin-4-yl]oxy-3-fluor...
Create Date: 2009-04-13
CID: 25218739

3017. 2-aminopyridine analogue, 3; CHEMBL515858; BDBM28024 ...
MW:     546.567826 g/mol MF: C29H28F2N6O3
IUPAC name: N-[4-[2-amino-3-[(4-methylpiperazin-1-yl)methyl]pyridin-4-yl...
Create Date: 2009-04-13
CID: 25218738

3018. quinazolidinone analogue, 2c; BDBM27715; 5-fluoro-1-[4-(4-phenylcyclohex-3-en-1-yl)butyl]-1,2,3,4-tetrahydroquinazoline-2,4-dione
MW:     392.465903 g/mol MF: C24H25FN2O2
IUPAC name: 5-fluoro-1-[4-(4-phenylcyclohex-3-en-1-yl)butyl]quinazoline-...
Create Date: 2009-04-13
CID: 25218516

3019. CHEMBL239822; spiropiperidine analogue, 3; BDBM26947 ...
MW:     389.533140 g/mol MF: C25H31N3O
IUPAC name: 8-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-1-phenyl-1,3...
Create Date: 2009-03-16
CID: 25190624

3020. benzothiazole analogue, 16i; CHEMBL516782; BDBM26731 ...
MW:     497.652720 g/mol MF: C24H23N3O3S3
IUPAC name: N-[4-(4-methyl-1,3-benzothiazol-2-yl)phenyl]-1-thiophen-2-yl...
Create Date: 2009-03-16
CID: 25188508

3021. benzothiazole analogue, 16g; CHEMBL460798; BDBM26729 ...
MW:     518.071200 g/mol MF: C23H20ClN3O3S3
IUPAC name: N-[4-(6-chloro-1,3-benzothiazol-2-yl)phenyl]-1-thiophen-2-yl...
Create Date: 2009-03-16
CID: 25188507

3022. benzothiazole analogue, 15e; CHEMBL460127; BDBM26722 ...
MW:     483.669200 g/mol MF: C24H25N3O2S3
IUPAC name: 4-(6-methyl-1,3-benzothiazol-2-yl)-N-[(1-thiophen-2-ylsulfon...
Create Date: 2009-03-16
CID: 25188504

3023. benzothiazole analogue, 15c; CHEMBL460588; BDBM26720 ...
MW:     483.626140 g/mol MF: C23H21N3O3S3
IUPAC name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-thiophen-2-yl...
Create Date: 2009-03-16
CID: 25188503

3024. benzothiazole analogue, 13g; CHEMBL511421; BDBM26715 ...
MW:     526.070060 g/mol MF: C26H24ClN3O3S2
IUPAC name: 1-(3-chlorophenyl)sulfonyl-N-[4-(6-methyl-1,3-benzothiazol-2...
Create Date: 2009-03-16
CID: 25188228

3025. benzothiazole analogue, 13e; CHEMBL512590; BDBM26713 ...
MW:     509.615463 g/mol MF: C26H24FN3O3S2
IUPAC name: 1-(2-fluorophenyl)sulfonyl-N-[4-(6-methyl-1,3-benzothiazol-2...
Create Date: 2009-03-16
CID: 25188227

3026. benzothiazole analogue, 13b; CHEMBL513142; BDBM26710 ...
MW:     457.608780 g/mol MF: C23H27N3O3S2
IUPAC name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-propan-2-ylsu...
Create Date: 2009-03-16
CID: 25188226

3027. benzothiazole analogue, 16h; CHEMBL459919; BDBM26730 ...
MW:     513.652120 g/mol MF: C24H23N3O4S3
IUPAC name: N-[4-(6-methoxy-1,3-benzothiazol-2-yl)phenyl]-1-thiophen-2-y...
Create Date: 2009-03-16
CID: 25187966

3028. benzimidazole analogue, 16c; CHEMBL462682; BDBM26727 ...
MW:     480.602360 g/mol MF: C24H24N4O3S2
IUPAC name: N-[4-(6-methyl-1H-benzimidazol-2-yl)phenyl]-1-thiophen-2-yls...
Create Date: 2009-03-16
CID: 25187692

3029. benzothiazole analogue, 15d; CHEMBL460589; BDBM26721 ...
MW:     511.679300 g/mol MF: C25H25N3O3S3
IUPAC name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(1-thiophen-2...
Create Date: 2009-03-16
CID: 25187691

3030. benzothiazole analogue, 15b; CHEMBL518028; BDBM26719 ...
MW:     469.599560 g/mol MF: C22H19N3O3S3
IUPAC name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-thiophen-2-yl...
Create Date: 2009-03-16
CID: 25187409

3031. benzothiazole analogue, 13h; CHEMBL467427; BDBM26716 ...
MW:     526.070060 g/mol MF: C26H24ClN3O3S2
IUPAC name: 1-(4-chlorophenyl)sulfonyl-N-[4-(6-methyl-1,3-benzothiazol-2...
Create Date: 2009-03-16
CID: 25187408

3032. benzothiazole analogue, 13f; CHEMBL468258; BDBM26714 ...
MW:     526.070060 g/mol MF: C26H24ClN3O3S2
IUPAC name: 1-(2-chlorophenyl)sulfonyl-N-[4-(6-methyl-1,3-benzothiazol-2...
Create Date: 2009-03-16
CID: 25187407

3033. benzothiazole analogue, 13d; CHEMBL467426; BDBM26712 ...
MW:     491.625000 g/mol MF: C26H25N3O3S2
IUPAC name: 1-(benzenesulfonyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phe...
Create Date: 2009-03-16
CID: 25187406

3034. benzothiazole analogue, 13c; CHEMBL511915; BDBM26711 ...
MW:     458.596840 g/mol MF: C22H26N4O3S2
IUPAC name: 1-(dimethylsulfamoyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)p...
Create Date: 2009-03-16
CID: 25187405

3035. benzothiazole analogue, 13a; CHEMBL462465; BDBM26709 ...
MW:     443.582200 g/mol MF: C22H25N3O3S2
IUPAC name: 1-ethylsulfonyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]...
Create Date: 2009-03-16
CID: 25187404

3036. BI 2536 analogue, 2b; BDBM26516; 1-[4-(cyclopentylamino)-2-{[4-(4-methylpiperazin-1-yl)phenyl]amino}pyrimidin-5-yl]ethan-1-one
MW:     394.513200 g/mol MF: C22H30N6O
IUPAC name: 1-[4-(cyclopentylamino)-2-[4-(4-methylpiperazin-1-yl)anilino...
Create Date: 2009-01-30
CID: 25138221

3037. BI 2536 analogue, 2a; BDBM26515; 1-[4-(cyclopentylamino)-2-{[2-methoxy-4-(4-methylpiperazin-1-yl)phenyl]amino}pyrimidin-5-yl]ethan-1-one
MW:     424.539180 g/mol MF: C23H32N6O2
IUPAC name: 1-[4-(cyclopentylamino)-2-[2-methoxy-4-(4-methylpiperazin-1-...
Create Date: 2009-01-30
CID: 25138220

3038. Acylpiperazine analogue, 49; CHEMBL522487; BDBM27568 ...
MW:     476.542563 g/mol MF: C27H29FN4O3
IUPAC name: 4-[[3-[4-(cyclohexanecarbonyl)piperazine-1-carbonyl]-4-fluor...
Create Date: 2009-01-19
CID: 25133979

3039. Acylpiperazine analogue, 50; CHEMBL492671; BDBM27569 ...
MW:     464.488803 g/mol MF: C25H25FN4O4
IUPAC name: 4-[[4-fluoro-3-[4-(oxolane-2-carbonyl)piperazine-1-carbonyl]...
Create Date: 2009-01-19
CID: 25133978

3040. Acylpiperazine analogue, 48; CHEMBL524190; BDBM27567 ...
MW:     462.515983 g/mol MF: C26H27FN4O3
IUPAC name: 4-[[3-[4-(cyclopentanecarbonyl)piperazine-1-carbonyl]-4-fluo...
Create Date: 2009-01-19
CID: 25133977

3041. Acylpiperazine analogue, 46; CHEMBL494505; BDBM27565 ...
MW:     422.452123 g/mol MF: C23H23FN4O3
IUPAC name: 4-[[4-fluoro-3-(4-propanoylpiperazine-1-carbonyl)phenyl]meth...
Create Date: 2009-01-19
CID: 25133976

3042. Acylpiperazine analogue, 45; CHEMBL495322; SCHEMBL10091980 ...
MW:     408.425543 g/mol MF: C22H21FN4O3
IUPAC name: 4-[[3-(4-acetylpiperazine-1-carbonyl)-4-fluorophenyl]methyl]...
Create Date: 2009-01-19
CID: 25133975

3043. Homopiperazine analogue, 22; CHEMBL494875; BDBM27541 ...
MW:     448.489403 g/mol MF: C25H25FN4O3
IUPAC name: 4-[[3-[4-(cyclopropanecarbonyl)-1,4-diazepane-1-carbonyl]-4-...
Create Date: 2009-01-19
CID: 25132611

3044. Homopiperazine analogue, 21; CHEMBL523879; BDBM27540 ...
MW:     422.452123 g/mol MF: C23H23FN4O3
IUPAC name: 4-[[3-(4-acetyl-1,4-diazepane-1-carbonyl)-4-fluorophenyl]met...
Create Date: 2009-01-19
CID: 25132610

3045. Homopiperazine analogue, 20; CHEMBL494874; BDBM27539 ...
MW:     493.530023 g/mol MF: C26H28FN5O4
IUPAC name: 4-[[4-fluoro-3-[4-(morpholine-4-carbonyl)-1,4-diazepane-1-ca...
Create Date: 2009-01-19
CID: 25132609

3046. Homopiperazine analogue, 19; CHEMBL495484; BDBM27538 ...
MW:     475.539560 g/mol MF: C26H29N5O4
IUPAC name: 4-[[3-[4-(morpholine-4-carbonyl)-1,4-diazepane-1-carbonyl]ph...
Create Date: 2009-01-19
CID: 25132261

3047. Homopiperazine analogue, 18; CHEMBL522885; BDBM27537 ...
MW:     454.541940 g/mol MF: C23H26N4O4S
IUPAC name: 4-[[3-(4-ethylsulfonyl-1,4-diazepane-1-carbonyl)phenyl]methy...
Create Date: 2009-01-19
CID: 25132260

3048. Homopiperazine analogue, 17; CHEMBL495483; BDBM27536 ...
MW:     452.547520 g/mol MF: C28H28N4O2
IUPAC name: 4-[[3-(4-benzyl-1,4-diazepane-1-carbonyl)phenyl]methyl]-2H-p...
Create Date: 2009-01-19
CID: 25132259

3049. Homopiperazine analogue, 16; CHEMBL523887; SCHEMBL17173535 ...
MW:     424.468003 g/mol MF: C23H25FN4O3
IUPAC name: 4-[[4-fluoro-3-[4-(2-hydroxyethyl)-1,4-diazepane-1-carbonyl]...
Create Date: 2009-01-19
CID: 25132258

3050. Homopiperazine analogue, 15; CHEMBL505041; BDBM27534 ...
MW:     406.477540 g/mol MF: C23H26N4O3
IUPAC name: 4-[[3-[4-(2-hydroxyethyl)-1,4-diazepane-1-carbonyl]phenyl]me...
Create Date: 2009-01-19
CID: 25132257

3051. Acylpiperazine analogue, 51; CHEMBL524165; BDBM27570 ...
MW:     464.488803 g/mol MF: C25H25FN4O4
IUPAC name: 4-[[4-fluoro-3-[4-(oxolane-3-carbonyl)piperazine-1-carbonyl]...
Create Date: 2009-01-19
CID: 25128834

3052. 3-Cl-AHPC analogue, 9; CHEMBL461199; BDBM25130 ...
MW:     370.869220 g/mol MF: C22H23ClO3
IUPAC name: (E)-3-[3-chloro-4-[4-hydroxy-3-(1-methylcyclohexyl)phenyl]ph...
Create Date: 2008-11-14
CID: 25023782

3053. 3-Cl-AHPC analogue, 8; CHEMBL518627; BDBM25129 ...
MW:     394.890620 g/mol MF: C24H23ClO3
Create Date: 2008-11-14
CID: 25023781

3054. 3-Cl-AHPC analogue, 5; CHEMBL459710; BDBM25126 ...
MW:     276.690103 g/mol MF: C15H10ClFO2
IUPAC name: (E)-3-[3-chloro-4-(4-fluorophenyl)phenyl]prop-2-enoic acid
Create Date: 2008-11-14
CID: 25023780

3055. 3-Cl-AHPC analogue, 4; CHEMBL459497; BDBM25125 ...
MW:     410.908263 g/mol MF: C25H24ClFO2
IUPAC name: (E)-3-[4-[3-(1-adamantyl)-4-fluorophenyl]-3-chlorophenyl]pro...
Create Date: 2008-11-14
CID: 25023779

3056. 3-Cl-AHPC analogue, 3; CHEMBL461827; BDBM25124 ...
MW:     407.932440 g/mol MF: C25H26ClNO2
IUPAC name: (E)-3-[4-[3-(1-adamantyl)-4-aminophenyl]-3-chlorophenyl]prop...
Create Date: 2008-11-14
CID: 25023778

3057. 3-Cl-AHPC analogue, 2; CHEMBL461620; BDBM25123 ...
MW:     449.969120 g/mol MF: C27H28ClNO3
IUPAC name: (E)-3-[4-[4-acetamido-3-(1-adamantyl)phenyl]-3-chlorophenyl]...
Create Date: 2008-11-14
CID: 25023777

3058. thienopyrimidine analogue, 2; SCHEMBL13861829; BDBM25114 ...
MW:     346.405660 g/mol MF: C19H14N4OS
IUPAC name: N-[4-(4-aminothieno[2,3-d]pyrimidin-5-yl)phenyl]benzamide
Create Date: 2008-11-14
CID: 25023775

3059. 5-(4-aminophenyl)thieno[2,3-d]pyrimidin-4-amine; 501696-28-2; Thieno[2,3-d]pyrimidin-4-amine, 5-(4-aminophenyl)- ...
MW:     242.299600 g/mol MF: C12H10N4S
IUPAC name: 5-(4-aminophenyl)thieno[2,3-d]pyrimidin-4-amine
Create Date: 2008-11-14
CID: 25023774

3060. pyrazolopyridine analog, 9j; CHEMBL226332; BDBM16792 ...
MW:     379.842820 g/mol MF: C20H18ClN5O
IUPAC name: (2S)-1-[5-(3-chloro-2H-pyrazolo[3,4-c]pyridin-5-yl)pyridin-3...
Create Date: 2008-01-19
CID: 23647438

3061. pyrazolopyridine analog, 9i; CHEMBL376570; SCHEMBL14418050 ...
MW:     359.424340 g/mol MF: C21H21N5O
IUPAC name: (2S)-1-[5-(3-methyl-2H-pyrazolo[3,4-c]pyridin-5-yl)pyridin-3...
Create Date: 2008-01-19
CID: 23647437

3062. pyrazolopyridine analog, 9h; CHEMBL226331; BDBM16790 ...
MW:     345.397760 g/mol MF: C20H19N5O
IUPAC name: (2S)-1-phenyl-3-[5-(1H-pyrazolo[3,4-c]pyridin-5-yl)pyridin-3...
Create Date: 2008-01-19
CID: 23647436

3063. pyrazolopyridine analog, 9g; pyrazolopyridine-pyridine, 6; CHEMBL376569 ...
MW:     398.460380 g/mol MF: C23H22N6O
IUPAC name: (2S)-1-(1H-indol-3-yl)-3-[5-(3-methyl-2H-pyrazolo[3,4-c]pyri...
Create Date: 2008-01-19
CID: 23647380

3064. N-pyrazinylurea Analog 29e; CHEMBL383670; BDBM14644 ...
MW:     383.447500 g/mol MF: C19H25N7O2
IUPAC name: 1-(5-cyanopyrazin-2-yl)-3-[4-[[2-(dimethylamino)ethyl-methyl...
Create Date: 2008-01-19
CID: 23646829

3065. N-pyrazinylurea Analog 29d; CHEMBL207778; BDBM14643 ...
MW:     352.390400 g/mol MF: C18H20N6O2
IUPAC name: 1-(5-cyanopyrazin-2-yl)-3-[2-methoxy-4-(pyrrolidin-1-ylmethy...
Create Date: 2008-01-19
CID: 23646828

3066. N-pyrazinylurea Analog 29c; CHEMBL208537; BDBM14642 ...
MW:     381.431620 g/mol MF: C19H23N7O2
IUPAC name: 1-(5-cyanopyrazin-2-yl)-3-[2-methoxy-4-[(4-methylpiperazin-1...
Create Date: 2008-01-19
CID: 23646827

3067. N-pyrazinylurea Analog 29b; CHEMBL381172; BDBM14641 ...
MW:     368.389800 g/mol MF: C18H20N6O3
IUPAC name: 1-(5-cyanopyrazin-2-yl)-3-[2-methoxy-4-(morpholin-4-ylmethyl...
Create Date: 2008-01-19
CID: 23646826

3068. N-pyrazinylurea Analog 29a; CHEMBL205449; BDBM14640 ...
MW:     366.416980 g/mol MF: C19H22N6O2
IUPAC name: 1-(5-cyanopyrazin-2-yl)-3-[2-methoxy-4-(piperidin-1-ylmethyl...
Create Date: 2008-01-19
CID: 23646825

3069. N-pyrazinylurea Analog 22c; CHEMBL205590; BDBM14637 ...
MW:     458.944480 g/mol MF: C21H27ClN8O2
IUPAC name: 1-[5-chloro-2-[2-(dimethylamino)ethoxy]-4-(4-methylpiperazin...
Create Date: 2008-01-19
CID: 23646822

3070. N-pyrazinylurea Analog 22b; CHEMBL205699; BDBM14636 ...
MW:     478.934120 g/mol MF: C23H23ClN8O2
IUPAC name: 1-[5-chloro-4-(4-methylpiperazin-1-yl)-2-(pyridin-3-ylmethox...
Create Date: 2008-01-19
CID: 23646821

3071. N-pyrazinylurea Analog 22a; CHEMBL205543; BDBM14635 ...
MW:     457.913360 g/mol MF: C21H24ClN7O3
IUPAC name: 1-[5-chloro-4-(4-methylpiperazin-1-yl)-2-(oxolan-3-yloxy)phe...
Create Date: 2008-01-19
CID: 23646820

3072. N-pyrazinylurea Analog 19e; BDBM14634; 1-[5-chloro-4-(oxolan-3-ylmethoxy)-2-(pyrrolidin-1-yl)phenyl]-3-(5-cyanopyrazin-2-yl)urea
MW:     442.898720 g/mol MF: C21H23ClN6O3
IUPAC name: 1-[5-chloro-4-(oxolan-3-ylmethoxy)-2-pyrrolidin-1-ylphenyl]-...
Create Date: 2008-01-19
CID: 23646819

3073. N-pyrazinylurea Analog 19d; CHEMBL205744; BDBM14633 ...
MW:     449.892900 g/mol MF: C22H20ClN7O2
IUPAC name: 1-[5-chloro-4-(pyridin-3-ylmethoxy)-2-pyrrolidin-1-ylphenyl]...
Create Date: 2008-01-19
CID: 23646818

3074. N-pyrazinylurea Analog 19c; CHEMBL377304; BDBM14632 ...
MW:     531.050200 g/mol MF: C25H35ClN8O3
IUPAC name: 1-[5-chloro-4-[2-[2-[2-(dimethylamino)ethoxy]ethyl-methylami...
Create Date: 2008-01-19
CID: 23646817

3075. N-pyrazinylurea Analog 19b; CHEMBL206663; BDBM14631 ...
MW:     473.955820 g/mol MF: C22H28ClN7O3
IUPAC name: 1-[5-chloro-4-[2-[2-(dimethylamino)ethoxy]ethoxy]-2-pyrrolid...
Create Date: 2008-01-19
CID: 23646816

3076. N-pyrazinylurea Analog 19a; CHEMBL206812; BDBM14630 ...
MW:     429.903260 g/mol MF: C20H24ClN7O2
IUPAC name: 1-[5-chloro-4-[2-(dimethylamino)ethoxy]-2-pyrrolidin-1-ylphe...
Create Date: 2008-01-19
CID: 23646815

3077. benzenesulfonamide analog 16; BDBM12206; (2S)-N-[(2S,3R)-3-hydroxy-4-{[4-(N''-hydroxycarbamimidoyl)benzene](2-methylpropyl)sulfonamido}-1-phenylbutan-2-yl]-3-methyl-2-{3-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-oxoimidazolidin-1-yl}butanamide
MW:     713.910280 g/mol MF: C34H47N7O6S2
IUPAC name: (2S)-N-[(2S,3R)-3-hydroxy-4-[[4-[(Z)-N'-hydroxycarbamimidoyl...
Create Date: 2008-01-19
CID: 23645110

3078. benzenesulfonamide analog 13; CHEMBL371514; SCHEMBL1057782 ...
MW:     697.907580 g/mol MF: C35H47N5O6S2
IUPAC name: (2S)-N-[(2S,3R)-4-[(4-acetylphenyl)sulfonyl-(2-methylpropyl)...
Create Date: 2008-01-19
CID: 23645109

3079. lysine sulfonamide analogue 7; BDBM10143; methyl N-[(1S)-1-{[(5R)-5-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-6-hydroxyhexyl]carbamoyl}-3-phenylpropyl]carbamate
MW:     562.721280 g/mol MF: C28H42N4O6S
IUPAC name: methyl N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropy...
Create Date: 2008-01-19
CID: 23645093

3080. lysine sulfonamide analogue 6; BDBM10142; methyl N-[(S)-{[(5R)-5-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-6-hydroxyhexyl]carbamoyl}(phenyl)methyl]carbamate
MW:     534.668120 g/mol MF: C26H38N4O6S
IUPAC name: methyl N-[(1S)-2-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropy...
Create Date: 2008-01-19
CID: 23645092

3081. lysine sulfonamide analogue 5; BDBM10141; methyl N-[(1S)-1-{[(5R)-5-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-6-hydroxyhexyl]carbamoyl}-2-phenylethyl]carbamate
MW:     548.694700 g/mol MF: C27H40N4O6S
IUPAC name: methyl N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropy...
Create Date: 2008-01-19
CID: 23645091

3082. RU54115 Analog 51; CHEMBL349514; BDBM10072 ...
MW:     418.655560 g/mol MF: C24H34O2S2
IUPAC name: (10R,13S)-10-[2,2-bis(ethylsulfanyl)ethyl]-13-methyl-2,6,7,8...
Create Date: 2008-01-19
CID: 23645051

3083. RU54115 Analog 50; CHEMBL351226; BDBM10071 ...
MW:     390.602400 g/mol MF: C22H30O2S2
IUPAC name: (10R,13S)-10-[2,2-bis(methylsulfanyl)ethyl]-13-methyl-2,6,7,...
Create Date: 2008-01-19
CID: 23645050

3084. RU54115 Analog 43; CHEMBL166032; BDBM10070 ...
MW:     355.493700 g/mol MF: C21H25NO2S
IUPAC name: 2-[(10R,13S)-13-methyl-3,17-dioxo-2,6,7,8,12,14,15,16-octahy...
Create Date: 2008-01-19
CID: 23645049

3085. RU54115 Analog 32; CHEMBL165106; BDBM10069 ...
MW:     362.501283 g/mol MF: C21H27FO2S
IUPAC name: (10R,13S)-10-[2-(fluoromethylsulfanyl)ethyl]-13-methyl-2,6,7...
Create Date: 2008-01-19
CID: 23645048

3086. RU54115 Analog 31; CHEMBL350713; BDBM10068 ...
MW:     354.505640 g/mol MF: C22H26O2S
IUPAC name: (10R,13S)-10-(2-ethynylsulfanylethyl)-13-methyl-2,6,7,8,12,1...
Create Date: 2008-01-19
CID: 23645047

3087. RU54115 Analog 29; CHEMBL166079; BDBM10067 ...
MW:     370.548100 g/mol MF: C23H30O2S
IUPAC name: (10R,13S)-10-(2-cyclopropylsulfanylethyl)-13-methyl-2,6,7,8,...
Create Date: 2008-01-19
CID: 23645046

3088. RU54115 Analog 28; CHEMBL349851; BDBM10066 ...
MW:     438.645200 g/mol MF: C26H30O2S2
IUPAC name: (10R,13S)-13-methyl-10-[2-(phenyldisulfanyl)ethyl]-2,6,7,8,1...
Create Date: 2008-01-19
CID: 23645045

3089. RU54115 Analog 27; CHEMBL352891; BDBM10065 ...
MW:     376.575820 g/mol MF: C21H28O2S2
IUPAC name: (10R,13S)-13-methyl-10-[2-(methyldisulfanyl)ethyl]-2,6,7,8,1...
Create Date: 2008-01-19
CID: 23645044

3090. RU54115 Analog 26; CHEMBL164543; BDBM10064 ...
MW:     356.521520 g/mol MF: C22H28O2S
IUPAC name: (10R,13S)-10-(2-ethenylsulfanylethyl)-13-methyl-2,6,7,8,12,1...
Create Date: 2008-01-19
CID: 23645043

3091. RU54115 Analog 24; CHEMBL351526; BDBM10063 ...
MW:     370.548100 g/mol MF: C23H30O2S
IUPAC name: (10R,13S)-13-methyl-10-(2-prop-2-enylsulfanylethyl)-2,6,7,8,...
Create Date: 2008-01-19
CID: 23645042

3092. RU54115 Analog 23; CHEMBL353571; BDBM10062 ...
MW:     390.602400 g/mol MF: C22H30O2S2
IUPAC name: (10R,13S)-13-methyl-10-[2-(methylsulfanylmethylsulfanyl)ethy...
Create Date: 2008-01-19
CID: 23645041

3093. RU54115 Analog 22; CHEMBL424162; BDBM10061 ...
MW:     368.532220 g/mol MF: C23H28O2S
IUPAC name: (10R,13S)-13-methyl-10-(2-prop-2-ynylsulfanylethyl)-2,6,7,8,...
Create Date: 2008-01-19
CID: 23645040

3094. RU54115 Analog 21; CHEMBL165552; BDBM10060 ...
MW:     528.640320 g/mol MF: C26H28N2O6S2
IUPAC name: (10R,13S)-10-[2-[(2,4-dinitrophenyl)disulfanyl]ethyl]-13-met...
Create Date: 2008-01-19
CID: 23645039

3095. RU54115 Analog 20; CHEMBL166148; BDBM10059 ...
MW:     380.491746 g/mol MF: C21H26F2O2S
IUPAC name: (10R,13S)-10-[2-(difluoromethylsulfanyl)ethyl]-13-methyl-2,6...
Create Date: 2008-01-19
CID: 23645038

3096. RU54115 Analog 17; CHEMBL165279; BDBM10058 ...
MW:     390.602400 g/mol MF: C22H30O2S2
IUPAC name: (10R,13S)-13-methyl-10-[2-(2-sulfanylethylsulfanyl)ethyl]-2,...
Create Date: 2008-01-19
CID: 23645037

3097. RU54115 Analog 16; CHEMBL351850; BDBM10057 ...
MW:     392.982460 g/mol MF: C22H29ClO2S
IUPAC name: (10R,13S)-10-[2-(2-chloroethylsulfanyl)ethyl]-13-methyl-2,6,...
Create Date: 2008-01-19
CID: 23645036

3098. RU54115 Analog 15; CHEMBL423096; BDBM10056 ...
MW:     374.536800 g/mol MF: C22H30O3S
IUPAC name: (10R,13S)-10-[2-(2-hydroxyethylsulfanyl)ethyl]-13-methyl-2,6...
Create Date: 2008-01-19
CID: 23645035

3099. RU54115 Analog 13; CHEMBL349919; BDBM10055 ...
MW:     372.520920 g/mol MF: C22H28O3S
IUPAC name: S-[2-[(10R,13S)-13-methyl-3,17-dioxo-2,6,7,8,12,14,15,16-oct...
Create Date: 2008-01-19
CID: 23645034

3100. RU54115 Analog 54; CHEMBL164746; BDBM10048 ...
MW:     358.537400 g/mol MF: C22H30O2S
IUPAC name: (10R,13S)-13-methyl-10-(3-methylsulfanylpropyl)-2,6,7,8,12,1...
Create Date: 2008-01-19
CID: 23645027

3101. RU54115 Analog 12; CHEMBL165218; BDBM10047 ...
MW:     358.537400 g/mol MF: C22H30O2S
IUPAC name: (10R,13S)-10-(2-ethylsulfanylethyl)-13-methyl-2,6,7,8,12,14,...
Create Date: 2008-01-19
CID: 23645026

3102. RU54115 Analog 34; CHEMBL350074; BDBM10046 ...
MW:     346.526700 g/mol MF: C21H30O2S
IUPAC name: (10S,13S)-13-methyl-10-(2-methylsulfanylethyl)-2,6,7,8,9,11,...
Create Date: 2008-01-19
CID: 23645025

3103. RU54115 Analog 53; CHEMBL165342; BDBM10043 ...
MW:     316.457660 g/mol MF: C19H24O2S
IUPAC name: (10R,13S)-13-methyl-10-methylsulfanyl-2,6,7,8,12,14,15,16-oc...
Create Date: 2008-01-19
CID: 23645024

3104. P3 thienothiophene analog 6; BDBM9156; (2R,4S)-N-[(3S)-3beta-Hydroxy-3,4-dihydro-2H-1-benzopyran-4beta-yl]-2-(4-pyridinylmethyl)-4-hydroxy-5-[(2S)-2alpha-(2,2,2-trifluoroethylcarbamoyl)-4-(thieno[2,3-b]thiophene-2-ylmethyl)piperazino]pentanamide ...
MW:     717.821230 g/mol MF: C34H38F3N5O5S2
IUPAC name: (2S)-1-[(2S,4R)-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4-dihydro-...
Create Date: 2008-01-19
CID: 23644608

3105. P3 pyridyl oxazole analog 6; BDBM9148; (2R,4S)-N-[(3S)-3beta-Hydroxy-3,4-dihydro-2H-1-benzopyran-4beta-yl]-2-benzyl-4-hydroxy-5-[(2S)-2alpha-(2,2,2-trifluoroethylcarbamoyl)-4-[5-(4-pyridinyl)-2-oxazolylmethyl]piperazino]pentanamide ...
MW:     722.753250 g/mol MF: C37H41F3N6O6
IUPAC name: (2S)-1-[(2S,4R)-4-benzyl-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4...
Create Date: 2008-01-19
CID: 23644607

3106. 3-Cl-AHPC analogue, 6; CHEMBL459711; SCHEMBL12257890 ...
MW:     354.826760 g/mol MF: C21H19ClO3
IUPAC name: (E)-3-[3-chloro-4-[3-(3,3-dimethylbut-1-ynyl)-4-hydroxypheny...
Create Date: 2007-12-07
CID: 23577109

3107. 3-Cl-AHPC analogue, 7; CHEMBL459712; SCHEMBL12257892 ...
MW:     378.848160 g/mol MF: C23H19ClO3
IUPAC name: (E)-3-[3-chloro-4-[3-(2,6-dimethylphenyl)-4-hydroxyphenyl]ph...
Create Date: 2007-12-07
CID: 23577108

3108. P3 thienothiophene analog 5; BDBM9155; SCHEMBL5255083 ...
MW:     717.821230 g/mol MF: C34H38F3N5O5S2
IUPAC name: (2S)-1-[(2S,4R)-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4-dihydro-...
Create Date: 2007-12-05
CID: 20598984

3109. quinazolidinone analogue, 2a; SCHEMBL7305161; BDBM27713 ...
MW:     375.463500 g/mol MF: C23H25N3O2
IUPAC name: 1-[4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]quinazoline...
Create Date: 2007-12-04
CID: 19087731

3110. F2727-0217; benzothiazole analogue, 16a; CHEMBL461411 ...
MW:     483.626140 g/mol MF: C23H21N3O3S3
IUPAC name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-thiophen-2-ylsulfonylp...
Create Date: 2007-11-13
CID: 16830520

3111. benzothiazole analogue, 15a; CHEMBL461435; BDBM26718 ...
MW:     497.652720 g/mol MF: C24H23N3O3S3
IUPAC name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-thiophen-2-yl...
Create Date: 2007-11-13
CID: 16826098

3112. T5655688; benzothiazole analogue, 14a; CHEMBL467428 ...
MW:     461.599020 g/mol MF: C25H23N3O2S2
IUPAC name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-(thiophene-2-...
Create Date: 2007-07-30
CID: 16363795

3113. TYIFEVFDQKEE; CD4(81-92) Analog; Thr-Tyr-Ile-Phe-Glu-Val-Phe-Asp-Gln-Lys-Glu-Glu
MW:    1547.659680 g/mol MF: C72H102N14O24
IUPAC name: (2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-5-amino-2-[[(2S)-2-[...
Create Date: 2007-07-03
CID: 16130163

3114. alpha-ketothiazole analogue 9; BDBM12949; ethyl 2-({[(1S)-1-{[(1S)-1-{[(2S)-5-carbamimidamido-1-oxo-1-(1,3-thiazol-2-yl)pentan-2-yl]carbamoyl}-2-methylpropyl]carbamoyl}-2-phenylethyl]carbamoyl}amino)-3-phenylpropanoate
MW:     706.854740 g/mol MF: C35H46N8O6S
IUPAC name: ethyl 2-[[(2S)-1-[[(2S)-1-[[(2S)-5-(diaminomethylideneamino)...
Create Date: 2007-06-18
CID: 16098889

3115. alpha-ketothiazole analogue 8; BDBM12948; (2S)-N-[(2S)-5-carbamimidamido-1-oxo-1-(1,3-thiazol-2-yl)pentan-2-yl]-2-[(2S)-2-({[(4-fluorophenyl)methyl]carbamoyl}amino)-3-phenylpropanamido]-3-methylbutanamide
MW:     638.755963 g/mol MF: C31H39FN8O4S
IUPAC name: (2S)-N-[(2S)-5-(diaminomethylideneamino)-1-oxo-1-(1,3-thiazo...
Create Date: 2007-06-18
CID: 16098888

3116. pyrazolopyridine analog, 9f; CHEMBL226330; BDBM16789 ...
MW:     384.433800 g/mol MF: C22H20N6O
IUPAC name: (2S)-1-(1H-indol-3-yl)-3-[5-(1H-pyrazolo[3,4-c]pyridin-5-yl)...
Create Date: 2007-04-19
CID: 16040274

3117. 86312-75-6; Phthalonitrile analogue, 4b; 4-(Benzyloxy)Phthalonitrile ...
MW:     234.252700 g/mol MF: C15H10N2O
IUPAC name: 4-phenylmethoxybenzene-1,2-dicarbonitrile
Create Date: 2007-02-12
CID: 15569251

3118. CHEMBL240657; spiropiperidine analogue, 9; SCHEMBL5244772 ...
MW:     397.512080 g/mol MF: C26H27N3O
IUPAC name: 8-benzhydryl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
Create Date: 2007-02-10
CID: 15541261

3119. 131574-31-7; Hamburger Pentapeptide Analog; CHEMBL18338 ...
MW:     591.568880 g/mol MF: C22H37N7O12
IUPAC name: (2S)-6-amino-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino...
Create Date: 2007-02-09
CID: 14704061

3120. 2,6-dimethylphenserine; Phenserine methyl analog 11; CHEMBL340867 ...
MW:     365.468680 g/mol MF: C22H27N3O2
IUPAC name: [(3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]in...
Create Date: 2007-02-09
CID: 14349781

3121. 2,4,6-trimethylphenserine; Phenserine methyl analog 14; CHEMBL130363 ...
MW:     379.495260 g/mol MF: C23H29N3O2
IUPAC name: [(3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]in...
Create Date: 2007-02-08
CID: 13006043

3122. 2,5-dimethylphenserine; Phenserine methyl analog 10; CHEMBL337675 ...
MW:     365.468680 g/mol MF: C22H27N3O2
IUPAC name: [(3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]in...
Create Date: 2007-02-08
CID: 13006040

3123. 6H-Cyclohepta[b]quinolin-11-amine, 1-chloro-7,8,9,10-tetrahydro-; 122994-75-6; 1-chloro-6H,7H,8H,9H,10H-cyclohepta[b]quinolin-11-amine ...
MW:     246.735300 g/mol MF: C14H15ClN2
IUPAC name: 1-chloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-ami...
Create Date: 2007-02-07
CID: 12051103

3124. Benzothiazole analogue, 31; CHEMBL209522; SCHEMBL5040014 ...
MW:     378.859740 g/mol MF: C14H11ClN6OS2
IUPAC name: 2-[6-amino-8-[(7-chloro-1,3-benzothiazol-2-yl)sulfanyl]purin...
Create Date: 2006-11-06
CID: 11850899

3125. Pyridothiazole analogue, 28; CHEMBL377958; SCHEMBL5531190 ...
MW:     391.901560 g/mol MF: C15H14ClN7S2
IUPAC name: 9-butyl-8-[(7-chloro-[1,3]thiazolo[4,5-c]pyridin-2-yl)sulfan...
Create Date: 2006-11-06
CID: 11850898

3126. Pyridothiazole analogue, 26; CHEMBL377045; SCHEMBL14495054 ...
MW:     436.352560 g/mol MF: C15H14BrN7S2
IUPAC name: 8-[(7-bromo-[1,3]thiazolo[4,5-c]pyridin-2-yl)sulfanyl]-9-but...
Create Date: 2006-11-06
CID: 11850897

3127. CHEMBL377371; Benzothiazole analogue, 24; SCHEMBL5038594 ...
MW:     498.946562 g/mol MF: C18H20ClN6O3PS2
IUPAC name: 8-[(7-chloro-1,3-benzothiazol-2-yl)sulfanyl]-9-(2-diethoxyph...
Create Date: 2006-11-06
CID: 11850896

3128. Benzothiazole analogue, 22; CHEMBL212076; SCHEMBL14495091 ...
MW:     434.923000 g/mol MF: C17H15ClN6O2S2
IUPAC name: 3-[6-amino-8-[(7-chloro-1,3-benzothiazol-2-yl)sulfanyl]purin...
Create Date: 2006-11-06
CID: 11850895

3129. Benzothiazole analogue, 20; CHEMBL438068; SCHEMBL5040161 ...
MW:     404.940080 g/mol MF: C17H17ClN6S2
IUPAC name: 8-[(7-chloro-1,3-benzothiazol-2-yl)sulfanyl]-9-pentylpurin-6...
Create Date: 2006-11-06
CID: 11850894

3130. Benzothiazole analogue, 17; CHEMBL213584; SCHEMBL5043009 ...
MW:     400.521000 g/mol MF: C18H20N6OS2
IUPAC name: 9-butyl-8-[(7-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]purin-6-...
Create Date: 2006-11-06
CID: 11850893

3131. Benzothiazole analogue, 15; CHEMBL214400; SCHEMBL5518267 ...
MW:     425.358560 g/mol MF: C16H14Cl2N6S2
IUPAC name: 9-butyl-8-[(6,7-dichloro-1,3-benzothiazol-2-yl)sulfanyl]puri...
Create Date: 2006-11-06
CID: 11850834

3132. Benzothiazole analogue, 13; CHEMBL213801; SCHEMBL5040189 ...
MW:     374.458903 g/mol MF: C16H15FN6S2
IUPAC name: 9-butyl-8-[(7-fluoro-1,3-benzothiazol-2-yl)sulfanyl]purin-6-...
Create Date: 2006-11-06
CID: 11850833

3133. CHEMBL213262; Benzothiazole analogue, 11; SCHEMBL5039977 ...
MW:     390.913500 g/mol MF: C16H15ClN6S2
IUPAC name: 9-butyl-8-[(7-chloro-1,3-benzothiazol-2-yl)sulfanyl]purin-6-...
Create Date: 2006-11-06
CID: 11850832

3134. Benzothiazole analogue, 38; CHEMBL386780; SCHEMBL5521618 ...
MW:     433.981300 g/mol MF: C18H20ClN7S2
IUPAC name: 8-[(7-chloro-1,3-benzothiazol-2-yl)sulfanyl]-9-[3-(propan-2-...
Create Date: 2006-11-06
CID: 11850767

3135. CHEMBL215657; Benzothiazole analogue, 36; SCHEMBL5038912 ...
MW:     448.007880 g/mol MF: C19H22ClN7S2
IUPAC name: 8-[(7-chloro-1,3-benzothiazol-2-yl)sulfanyl]-9-[2-(2,2-dimet...
Create Date: 2006-11-06
CID: 11850766

3136. Benzothiazole analogue, 34; CHEMBL378338; SCHEMBL5133332 ...
MW:     447.964820 g/mol MF: C18H18ClN7OS2
IUPAC name: 8-[(7-chloro-1,3-benzothiazol-2-yl)sulfanyl]-9-(2-morpholin-...
Create Date: 2006-11-06
CID: 11850765

3137. Benzothiazole analogue, 32; CHEMBL379544; SCHEMBL4011084 ...
MW:     392.886320 g/mol MF: C15H13ClN6OS2
IUPAC name: 3-[6-amino-8-[(7-chloro-1,3-benzothiazol-2-yl)sulfanyl]purin...
Create Date: 2006-11-06
CID: 11850764

3138. Pyridothiazole analogue, 30; CHEMBL377024; SCHEMBL5038917 ...
MW:     435.911060 g/mol MF: C16H14ClN7O2S2
IUPAC name: 3-[6-amino-8-[(7-chloro-[1,3]thiazolo[4,5-c]pyridin-2-yl)sul...
Create Date: 2006-11-06
CID: 11850703

3139. CHEMBL212850; Pyridothiazole analogue, 29; SCHEMBL14495051 ...
MW:     499.934622 g/mol MF: C17H19ClN7O3PS2
IUPAC name: 8-[(7-chloro-[1,3]thiazolo[4,5-c]pyridin-2-yl)sulfanyl]-9-(2...
Create Date: 2006-11-06
CID: 11850702

3140. CHEMBL212133; Pyridothiazole analogue, 27; SCHEMBL5038581 ...
MW:     544.385622 g/mol MF: C17H19BrN7O3PS2
IUPAC name: 8-[(7-bromo-[1,3]thiazolo[4,5-c]pyridin-2-yl)sulfanyl]-9-(2-...
Create Date: 2006-11-06
CID: 11850701

3141. Benzothiazole analogue, 25; CHEMBL385927; SCHEMBL5035433 ...
MW:     415.922960 g/mol MF: C17H14ClN7S2
IUPAC name: 5-[6-amino-8-[(7-chloro-1,3-benzothiazol-2-yl)sulfanyl]purin...
Create Date: 2006-11-06
CID: 11850700

3142. Benzothiazole analogue, 23; CHEMBL377631; SCHEMBL5045375 ...
MW:     448.949580 g/mol MF: C18H17ClN6O2S2
IUPAC name: 4-[6-amino-8-[(7-chloro-1,3-benzothiazol-2-yl)sulfanyl]purin...
Create Date: 2006-11-06
CID: 11850699

3143. Benzothiazole analogue, 21; CHEMBL448474; SCHEMBL5035081 ...
MW:     420.896420 g/mol MF: C16H13ClN6O2S2
IUPAC name: 2-[6-amino-8-[(7-chloro-1,3-benzothiazol-2-yl)sulfanyl]purin...
Create Date: 2006-11-06
CID: 11850698

3144. Benzothiazole analogue, 19; CHEMBL379345; SCHEMBL5521791 ...
MW:     376.886920 g/mol MF: C15H13ClN6S2
IUPAC name: 8-[(7-chloro-1,3-benzothiazol-2-yl)sulfanyl]-9-propylpurin-6...
Create Date: 2006-11-06
CID: 11850697

3145. Benzothiazole analogue, 18; CHEMBL438613; SCHEMBL5043379 ...
MW:     362.860340 g/mol MF: C14H11ClN6S2
IUPAC name: 8-[(7-chloro-1,3-benzothiazol-2-yl)sulfanyl]-9-ethylpurin-6-...
Create Date: 2006-11-06
CID: 11850636

3146. Benzothiazole analogue, 16; CHEMBL386399; SCHEMBL5514963 ...
MW:     386.494420 g/mol MF: C17H18N6OS2
IUPAC name: 9-butyl-8-[(7-methoxy-1,3-benzothiazol-2-yl)sulfanyl]purin-6...
Create Date: 2006-11-06
CID: 11850635

3147. Benzothiazole analogue, 14; CHEMBL386499; SCHEMBL5035222 ...
MW:     370.495020 g/mol MF: C17H18N6S2
IUPAC name: 9-butyl-8-[(7-methyl-1,3-benzothiazol-2-yl)sulfanyl]purin-6-...
Create Date: 2006-11-06
CID: 11850634

3148. Benzothiazole analogue, 12; CHEMBL386882; SCHEMBL5043120 ...
MW:     435.364500 g/mol MF: C16H15BrN6S2
IUPAC name: 8-[(7-bromo-1,3-benzothiazol-2-yl)sulfanyl]-9-butylpurin-6-a...
Create Date: 2006-11-06
CID: 11850633

3149. Benzothiazole analogue, 10; CHEMBL377647; SCHEMBL5043365 ...
MW:     390.913500 g/mol MF: C16H15ClN6S2
IUPAC name: 9-butyl-8-[(6-chloro-1,3-benzothiazol-2-yl)sulfanyl]purin-6-...
Create Date: 2006-11-06
CID: 11850632

3150. Benzothiazole analogue, 39; CHEMBL211528; SCHEMBL5038945 ...
MW:     448.007880 g/mol MF: C19H22ClN7S2
IUPAC name: 9-[3-(tert-butylamino)propyl]-8-[(7-chloro-1,3-benzothiazol-...
Create Date: 2006-11-06
CID: 11849870

3151. CHEMBL215947; Benzothiazole analogue, 37; SCHEMBL10149977 ...
MW:     417.938840 g/mol MF: C17H16ClN7S2
IUPAC name: 8-[(7-chloro-1,3-benzothiazol-2-yl)sulfanyl]-9-[2-(cycloprop...
Create Date: 2006-11-06
CID: 11849869

3152. Benzothiazole analogue, 35; CHEMBL384763; SCHEMBL5131358 ...
MW:     433.981300 g/mol MF: C18H20ClN7S2
IUPAC name: 9-[2-(tert-butylamino)ethyl]-8-[(7-chloro-1,3-benzothiazol-2...
Create Date: 2006-11-06
CID: 11849868

3153. Benzothiazole analogue, 33; CHEMBL379641; SCHEMBL5038839 ...
MW:     406.912900 g/mol MF: C16H15ClN6OS2
IUPAC name: 4-[6-amino-8-[(7-chloro-1,3-benzothiazol-2-yl)sulfanyl]purin...
Create Date: 2006-11-06
CID: 11849867

3154. benzenesulfonamide analog 21; SCHEMBL1059594; SCHEMBL1059599 ...
MW:     712.922220 g/mol MF: C35H48N6O6S2
IUPAC name: (2S)-N-[(2S,3R)-3-hydroxy-4-[[4-[(E)-methoxyiminomethyl]phen...
Create Date: 2006-10-27
CID: 11821078

3155. Capped Tripeptide Analog 5; CHEMBL189768; BDBM13169 ...
MW:     428.567640 g/mol MF: C24H36N4O3
IUPAC name: (2S)-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-1-[(2S)-3,3-dimethyl...
Create Date: 2006-10-26
CID: 11750738

3156. BIRB-796 Analog 41; CHEMBL341559; BDBM14850
MW:     570.681920 g/mol MF: C32H38N6O4
IUPAC name: N-[4-[3-tert-butyl-5-[[4-(2-morpholin-4-ylethoxy)naphthalen-...
Create Date: 2006-10-26
CID: 11731461

3157. BIRB-796 Analog 46; SCHEMBL295372; CHEMBL143886 ...
MW:     555.710340 g/mol MF: C33H41N5O3
IUPAC name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-[2-[(2S...
Create Date: 2006-10-26
CID: 11731370

3158. BIRB-796 Analog 37; SCHEMBL295398; CHEMBL141294 ...
MW:     527.657180 g/mol MF: C31H37N5O3
IUPAC name: 1-(2-benzyl-5-tert-butylpyrazol-3-yl)-3-[4-(2-morpholin-4-yl...
Create Date: 2006-10-26
CID: 11731112

3159. BIRB-796 Analog 44; CHEMBL336681; BDBM14856
MW:     526.672420 g/mol MF: C31H38N6O2
IUPAC name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-(2-pipe...
Create Date: 2006-10-26
CID: 11731102

3160. CHEMBL384701; 3-(3-chloro-4-fluorophenyl)-1-(7-cyano-1,2,3,4-tetrahydronaphthalen-2-yl)-1-(3-(4-methylpiperazin-1-yl)propyl)urea; 3-(3-chloro-4-fluorophenyl)-1-(7-cyano-1,2,3,4-tetrahydronaphthalen-2-yl)-1-[3-(4-methylpiperazin-1-yl)propyl]urea ...
MW:     484.008643 g/mol MF: C26H31ClFN5O
IUPAC name: 3-(3-chloro-4-fluorophenyl)-1-(7-cyano-1,2,3,4-tetrahydronap...
Create Date: 2006-10-26
CID: 11691555

3161. CHEMBL191074; CCT018159 analog 3; SCHEMBL5271923 ...
MW:     358.775700 g/mol MF: C18H15ClN2O4
IUPAC name: (6Z)-4-chloro-6-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-meth...
Create Date: 2006-10-26
CID: 11610160

3162. Cyl-2 hydroxamic acid analog
MW:     587.707600 g/mol MF: C30H45N5O7
IUPAC name: 6-[(3S,6R,9S,12S)-3-[(2S)-butan-2-yl]-6-[(4-methoxyphenyl)me...
Create Date: 2006-10-26
CID: 11512661

3163. BI 2536 analogue, 1b; SCHEMBL16971929; BDBM26514 ...
MW:     491.628380 g/mol MF: C27H37N7O2
IUPAC name: 4-[[(7R)-8-cyclopentyl-7-ethyl-5-methyl-6-oxo-7H-pteridin-2-...
Create Date: 2006-10-26
CID: 11511524

3164. CCT018159 analog 8; CHEMBL366215; BDBM15369 ...
MW:     359.763760 g/mol MF: C17H14ClN3O4
IUPAC name: (5Z)-5-(3-chloro-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene...
Create Date: 2006-10-26
CID: 11485186

3165. dimethyl amide analogue, 21; CHEMBL254456; SCHEMBL5673764 ...
MW:     534.683063 g/mol MF: C28H39FN2O5S
IUPAC name: [2-[(3,4-dimethylphenyl)methyl]-3-[[2-[3-fluoro-4-(methanesu...
Create Date: 2006-10-26
CID: 11478167

3166. Capped Tripeptide Analog 7; CHEMBL359565; BDBM13171 ...
MW:     438.562460 g/mol MF: C25H34N4O3
IUPAC name: (2S)-1-[(2S)-3,3-dimethyl-2-[[(2S)-2-(methylamino)propanoyl]...
Create Date: 2006-10-26
CID: 11476147

3167. CCT018159 analog 6; CHEMBL371380; SCHEMBL5270773 ...
MW:     330.765600 g/mol MF: C17H15ClN2O3
IUPAC name: (6Z)-4-chloro-3-hydroxy-6-[4-(4-methoxyphenyl)-5-methyl-1,2-...
Create Date: 2006-10-26
CID: 11450349

3168. Capped Tripeptide Analog 14; BDBM13178; H-N,N-Me2-Ala-Tle-(4S)-4-phenoxy-Pro-(R)-tetrahydronaphth-1-yl Amide ...
MW:     548.716160 g/mol MF: C32H44N4O4
IUPAC name: (2S,4S)-1-[(2S)-2-[[(2S)-2-(dimethylamino)propanoyl]amino]-3...
Create Date: 2006-10-26
CID: 11432796

3169. Capped Tripeptide Analog 6; CHEMBL185940; BDBM13170 ...
MW:     438.562460 g/mol MF: C25H34N4O3
IUPAC name: (2S)-1-[(2S)-3,3-dimethyl-2-[[(2S)-2-(methylamino)propanoyl]...
Create Date: 2006-10-26
CID: 11419255

3170. Capped Tripeptide Analog 9; CHEMBL189071; BDBM13173 ...
MW:     416.556940 g/mol MF: C23H36N4O3
IUPAC name: (2S)-1-[(2S)-3,3-dimethyl-2-[[(2S)-2-(methylamino)propanoyl]...
Create Date: 2006-10-26
CID: 11395933

3171. CCT018159 analog 7; CHEMBL426446; SCHEMBL4397663 ...
MW:     360.748520 g/mol MF: C17H13ClN2O5
IUPAC name: (5Z)-5-(3-chloro-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene...
Create Date: 2006-10-26
CID: 11382853

3172. Capped Tripeptide Analog 12; BDBM13176; H-N-Me-Ala-Chg-(4S)-4-phenoxy-Pro-(R)-tetrahydronaphth-1-yl Amide ...
MW:     560.726860 g/mol MF: C33H44N4O4
IUPAC name: (2S,4S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propano...
Create Date: 2006-10-26
CID: 11307508

3173. CHEMBL380648; KU-0058948; 4-(3-(1,4-diazepane-1-carbonyl)-4-fluorobenzyl)phthalazin-1(2H)-one ...
MW:     380.415443 g/mol MF: C21H21FN4O2
IUPAC name: 4-[[3-(1,4-diazepane-1-carbonyl)-4-fluorophenyl]methyl]-2H-p...
Create Date: 2006-10-26
CID: 11291932

3174. dimethyl amide analogue, 20; CHEMBL254455; SCHEMBL5674702 ...
MW:     516.692600 g/mol MF: C28H40N2O5S
IUPAC name: [2-[(3,4-dimethylphenyl)methyl]-3-[[2-[4-(methanesulfonamido...
Create Date: 2006-10-26
CID: 11260865

3175. Capped Tripeptide Analog 8; CHEMBL360180; BDBM13172 ...
MW:     476.610440 g/mol MF: C28H36N4O3
IUPAC name: (2S)-1-[(2S)-3,3-dimethyl-2-[[(2S)-2-(methylamino)propanoyl]...
Create Date: 2006-10-26
CID: 11236902

3176. CCT018159 analog 9; CHEMBL424811; BDBM15370 ...
MW:     373.790340 g/mol MF: C18H16ClN3O4
IUPAC name: (5Z)-5-(3-chloro-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene...
Create Date: 2006-10-26
CID: 11234160

3177. Capped Tripeptide Analog 3; CHEMBL2096803; BDBM13167 ...
MW:     442.594220 g/mol MF: C25H38N4O3
IUPAC name: (2S)-1-[(2S)-3,3-dimethyl-2-[[(2S)-2-(methylamino)propanoyl]...
Create Date: 2006-10-26
CID: 11166638

3178. Capped Tripeptide Analog 4; CHEMBL361282; BDBM13168 ...
MW:     428.567640 g/mol MF: C24H36N4O3
IUPAC name: (2S)-N-[(1R)-2,3-dihydro-1H-inden-1-yl]-1-[(2S)-3,3-dimethyl...
Create Date: 2006-10-26
CID: 11166263

3179. dimethyl amide analogue, 22; CHEMBL398652; SCHEMBL5674941 ...
MW:     546.718580 g/mol MF: C29H42N2O6S
IUPAC name: [2-[(3,4-dimethylphenyl)methyl]-3-[[2-[4-(methanesulfonamido...
Create Date: 2006-10-26
CID: 11157047

3180. CCT018159 analog 5; CHEMBL364968; SCHEMBL5267052 ...
MW:     375.216600 g/mol MF: C17H15BrN2O3
IUPAC name: (6Z)-4-bromo-3-hydroxy-6-[4-(4-methoxyphenyl)-5-methyl-1,2-d...
Create Date: 2006-10-26
CID: 11153045

3181. BIRB-796 Analog 48; CHEMBL343227; BDBM14860
MW:     519.636720 g/mol MF: C32H33N5O2
IUPAC name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-(2-pyri...
Create Date: 2006-10-26
CID: 11103319

3182. BIRB-796 Analog 39; CHEMBL342523; BDBM14848
MW:     570.681920 g/mol MF: C32H38N6O4
IUPAC name: N-[3-[3-tert-butyl-5-[[4-(2-morpholin-4-ylethoxy)naphthalen-...
Create Date: 2006-10-26
CID: 11060841

3183. 285983-72-4; UREA, N-[3-(1,1-DIMETHYLETHYL)-1-(4-METHYLPHENYL)-1H-PYRAZOL-5-YL]-N'-[4-[2-(1-PIPERIDINYL)ETHOXY]-1-NAPHTHALENYL]-; AGN-PC-0NF1R0 ...
MW:     525.684360 g/mol MF: C32H39N5O2
IUPAC name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-(2-pipe...
Create Date: 2006-10-26
CID: 11049675

3184. BIRB-796 Analog 36; CHEMBL423196; BDBM14846
MW:     519.678240 g/mol MF: C30H41N5O3
IUPAC name: 1-(5-tert-butyl-2-cyclohexylpyrazol-3-yl)-3-[4-(2-morpholin-...
Create Date: 2006-10-26
CID: 11005825

3185. BIRB-796 Analog 38; BIRB-796 derivative, 13; CHEMBL344800 ...
MW:     528.645240 g/mol MF: C30H36N6O3
IUPAC name: 1-[2-(3-aminophenyl)-5-tert-butylpyrazol-3-yl]-3-[4-(2-morph...
Create Date: 2006-10-26
CID: 10896702

3186. BIRB-796 Analog 45; SCHEMBL296227; CHEMBL139991 ...
MW:     555.710340 g/mol MF: C33H41N5O3
IUPAC name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-[2-[(2S...
Create Date: 2006-10-26
CID: 10875363

3187. CHEMBL104119; diaryl urea compound 1; BIRB-796 Analog 31 ...
MW:     457.524280 g/mol MF: C26H27N5O3
IUPAC name: 1-[4-(2-morpholin-4-ylethoxy)naphthalen-1-yl]-3-(2-phenylpyr...
Create Date: 2006-10-26
CID: 10863432

3188. Rapamycin C-7, analog 13; BDBM36624
MW:     898.129400 g/mol MF: C50H75NO13
Create Date: 2006-10-25
CID: 10463451

3189. Biphenyl Sulfonamide 1; 389623-63-6; arylsulfonamide analogue 12 ...
MW:     333.359000 g/mol MF: C16H15NO5S
IUPAC name: (3S)-4-oxo-3-[(2-phenylphenyl)sulfonylamino]butanoic acid
Create Date: 2006-10-25
CID: 10449481

3190. Rapamycin C-7, analog 6a; SCHEMBL17464795; BDBM36612
MW:     930.237460 g/mol MF: C51H79NO12S
Create Date: 2006-10-25
CID: 10396050

3191. Rapamycin C-7, analog 5a; BDBM36610
MW:     928.198440 g/mol MF: C52H81NO13
Create Date: 2006-10-25
CID: 10350852

3192. P3 pyridyl oxazole analog 8; BDBM9150; SCHEMBL5253511 ...
MW:     750.806410 g/mol MF: C39H45F3N6O6
IUPAC name: (2S)-1-[(2S,4R)-4-benzyl-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4...
Create Date: 2006-10-25
CID: 10305883

3193. BIRB-796 Analog 49; SCHEMBL300495; CHEMBL143141 ...
MW:     578.700620 g/mol MF: C35H38N4O4
IUPAC name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-[2-(3,4...
Create Date: 2006-10-25
CID: 10303645

3194. BIRB-796 Analog 50; SCHEMBL295577; CHEMBL336001 ...
MW:     508.614080 g/mol MF: C30H32N6O2
IUPAC name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-(2-imid...
Create Date: 2006-10-25
CID: 10301047

3195. Rapamycin C-7, analog 8a; BDBM36616
MW:    1020.293800 g/mol MF: C58H85NO14
Create Date: 2006-10-25
CID: 10260436

3196. BIRB-796 Analog 40; CHEMBL344625; BDBM14849
MW:     528.645240 g/mol MF: C30H36N6O3
IUPAC name: 1-[2-(4-aminophenyl)-5-tert-butylpyrazol-3-yl]-3-[4-(2-morph...
Create Date: 2006-10-25
CID: 10256389

3197. Rapamycin C-7, analog 12; SCHEMBL8273108; BDBM36623
MW:     884.145880 g/mol MF: C50H77NO12
Create Date: 2006-10-25
CID: 10234693

3198. BIRB-796 Analog 34; SCHEMBL296269; CHEMBL348228 ...
MW:     553.694460 g/mol MF: C33H39N5O3
IUPAC name: 1-[5-(1-methylcyclohexyl)-2-phenylpyrazol-3-yl]-3-[4-(2-morp...
Create Date: 2006-10-25
CID: 10231102

3199. diaryl urea compound 9; BIRB-796 Analog 30; SCHEMBL295686 ...
MW:     519.636720 g/mol MF: C32H33N5O2
IUPAC name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-(2-pyri...
Create Date: 2006-10-25
CID: 10229750

3200. P3 pyridyl oxazole analog 5; BDBM9147; SCHEMBL5256132 ...
MW:     722.753250 g/mol MF: C37H41F3N6O6
IUPAC name: (2S)-1-[(2S,4R)-4-benzyl-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4...
Create Date: 2006-10-25
CID: 10212356

3201. CHEMBL107850; diaryl urea compound 3; BIRB-796 Analog 11 ...
MW:     543.656580 g/mol MF: C31H37N5O4
IUPAC name: 1-[5-(1-hydroxy-2-methylpropan-2-yl)-2-(4-methylphenyl)pyraz...
Create Date: 2006-10-25
CID: 10209208

3202. CHEMBL105248; diaryl urea compound 7; BIRB-796 Analog 32 ...
MW:     499.604020 g/mol MF: C29H33N5O3
IUPAC name: 1-[4-(2-morpholin-4-ylethoxy)naphthalen-1-yl]-3-(2-phenyl-5-...
Create Date: 2006-10-25
CID: 10185343

3203. A313326 Analogue 7; CHEMBL351548; SCHEMBL5094150 ...
MW:     448.343860 g/mol MF: C25H19Cl2N3O
IUPAC name: 4-[[4-chloro-2-(2-chlorophenyl)phenyl]methoxy-(3-methylimida...
Create Date: 2006-10-25
CID: 10182250

3204. P3 pyridyl oxazole analog 9; BDBM9151; SCHEMBL5258967 ...
MW:     785.251470 g/mol MF: C39H44ClF3N6O6
IUPAC name: (2S)-1-[(2S,4R)-4-benzyl-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4...
Create Date: 2006-10-25
CID: 10169530

3205. BIRB-796 Analog 42; SCHEMBL294966; CHEMBL143373 ...
MW:     544.644640 g/mol MF: C30H36N6O4
IUPAC name: 1-[5-tert-butyl-2-(6-methoxypyridin-3-yl)pyrazol-3-yl]-3-[4-...
Create Date: 2006-10-25
CID: 10165915

3206. P3 pyridyl oxazole analog 4; BDBM9146; SCHEMBL5255015 ...
MW:     722.753250 g/mol MF: C37H41F3N6O6
IUPAC name: (2S)-1-[(2S,4R)-4-benzyl-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4...
Create Date: 2006-10-25
CID: 10146906

3207. BIRB-796 Analog 47; SCHEMBL295934; CHEMBL143207 ...
MW:     543.722780 g/mol MF: C31H37N5O2S
IUPAC name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-(2-thio...
Create Date: 2006-10-25
CID: 10143733

3208. Pent-4-ynyl analogue, 28; CHEMBL201684; SCHEMBL1963368 ...
MW:     483.301773 g/mol MF: C17H15FIN5OS
IUPAC name: 2-fluoro-8-(2-iodo-5-methoxyphenyl)sulfanyl-9-pent-4-ynylpur...
Create Date: 2006-10-25
CID: 10140801

3209. A313326 Analogue 8; CHEMBL157094; SCHEMBL5089025 ...
MW:     448.343860 g/mol MF: C25H19Cl2N3O
IUPAC name: 4-[[4-chloro-2-(3-chlorophenyl)phenyl]methoxy-(3-methylimida...
Create Date: 2006-10-25
CID: 10138638

3210. CHEMBL104749; diaryl urea compound 4; BIRB-796 Analog 35 ...
MW:     451.561220 g/mol MF: C25H33N5O3
IUPAC name: 1-(5-tert-butyl-2-methylpyrazol-3-yl)-3-[4-(2-morpholin-4-yl...
Create Date: 2006-10-25
CID: 10114928

3211. A313326 Analogue 9; CHEMBL158262; SCHEMBL5088972 ...
MW:     448.343860 g/mol MF: C25H19Cl2N3O
IUPAC name: 4-[[4-chloro-2-(4-chlorophenyl)phenyl]methoxy-(3-methylimida...
Create Date: 2006-10-25
CID: 10114664

3212. Rapamycin C-7, analog 8b; BDBM36617
MW:    1020.293800 g/mol MF: C58H85NO14
Create Date: 2006-10-25
CID: 10102537

3213. Rapamycin C-7, analog 6b; SCHEMBL17464797; BDBM36613
MW:     930.237460 g/mol MF: C51H79NO12S
Create Date: 2006-10-25
CID: 9962976

3214. CHEMBL101540; RU54115 Analog 57; BDBM10044 ...
MW:     332.500120 g/mol MF: C20H28O2S
IUPAC name: (10S,13S)-13-methyl-10-(methylsulfanylmethyl)-2,6,7,8,9,11,1...
Create Date: 2006-10-25
CID: 9949484

3215. CHEMBL104991; BIRB-796 Analog 17; SCHEMBL295694 ...
MW:     528.645240 g/mol MF: C30H36N6O3
IUPAC name: 1-[5-tert-butyl-2-(6-methylpyridin-3-yl)pyrazol-3-yl]-3-[4-(...
Create Date: 2006-10-25
CID: 9936768

3216. CHEMBL241272; spiropiperidine analogue, 2; BDBM26949 ...
MW:     466.402200 g/mol MF: C26H25Cl2N3O
IUPAC name: 8-[bis(2-chlorophenyl)methyl]-1-phenyl-1,3,8-triazaspiro[4.5...
Create Date: 2006-10-25
CID: 9934232

3217. CHEMBL318810; diaryl urea compound 8; BIRB-796 Analog 33 ...
MW:     513.630600 g/mol MF: C30H35N5O3
IUPAC name: 1-(5-tert-butyl-2-phenylpyrazol-3-yl)-3-[4-(2-morpholin-4-yl...
Create Date: 2006-10-25
CID: 9892658

3218. BIRB-796 Analog 25; SCHEMBL294931; CHEMBL142115 ...
MW:     559.722180 g/mol MF: C31H37N5O3S
IUPAC name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-[2-(1-o...
Create Date: 2006-10-25
CID: 9850770

3219. HDInhib_000058; Cyl-1 hydroxamic acid analog
MW:     573.681020 g/mol MF: C29H43N5O7
IUPAC name: 6-[(3S,6R,9S,12S)-3-[(2S)-butan-2-yl]-6-[(4-methoxyphenyl)me...
Create Date: 2006-10-25
CID: 9829602

3220. beta-Methylfentanyl; .beta.-Methylfentanyl; Propanamide, N-phenyl-N-(1-(2-phenylpropyl)-4-piperidinyl)- ...
MW:     350.497100 g/mol MF: C23H30N2O
IUPAC name: N-phenyl-N-[1-(2-phenylpropyl)piperidin-4-yl]propanamide
Create Date: 2006-04-28
CID: 6425761

3221. 2-[(5Z)-5-[[5-(4-iodophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid; 2-[(5Z)-5-{[5-(4-iodophenyl)furan-2-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid; AC1NZR89 ...
MW:     471.289370 g/mol MF: C16H10INO4S2
IUPAC name: 2-[(5Z)-5-[[5-(4-iodophenyl)furan-2-yl]methylidene]-4-oxo-2-...
Create Date: 2005-09-12
CID: 5971874

3222. ST50034046; [(5Z)-4-oxo-5-{[5-(4-sulfamoylphenyl)furan-2-yl]methylidene}-2-thioxo-1,3-thiazolidin-3-yl]acetic acid; 2-[(5Z)-4-oxo-5-[[5-(4-sulfamoylphenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid ...
MW:     424.471280 g/mol MF: C16H12N2O6S3
IUPAC name: 2-[(5Z)-4-oxo-5-[[5-(4-sulfamoylphenyl)furan-2-yl]methyliden...
Create Date: 2005-09-11
CID: 5940560

3223. XN1; 1k6t; AC1L9JWS ...
MW:     627.816060 g/mol MF: C37H49N5O4
IUPAC name: (2S)-N-tert-butyl-1-[(2S,4S,5S)-2-hydroxy-4-[[(1S,2R)-2-hydr...
Create Date: 2005-06-24
CID: 5496641

3224. AC1NTH3J; CCT018159 analog 2; CHEMBL188965 ...
MW:     324.330640 g/mol MF: C18H16N2O4
IUPAC name: (4Z)-4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1,2-di...
Create Date: 2005-07-08
CID: 5403772

3225. 4-[4-(4-methoxyphenyl)-5-methyl-1H-pyrazol-3-yl]benzene-1,3-diol; 4-(4-(4-methoxyphenyl)-5-methyl-1H-pyrazol-3-yl)benzene-1,3-diol; 2zdx ...
MW:     296.320540 g/mol MF: C17H16N2O3
IUPAC name: (4Z)-3-hydroxy-4-[4-(4-methoxyphenyl)-5-methyl-1,2-dihydropy...
Create Date: 2005-07-08
CID: 5403427

3226. 344897-95-6; AC1NSZD7; Ambcb5679982 ...
MW:     421.488800 g/mol MF: C22H15NO4S2
IUPAC name: 4-[5-[(Z)-(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-...
Create Date: 2005-07-28
CID: 5342077

3227. MLS-0146245.0001; 4-[5-[(Z)-[3-(4-nitrophenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoic acid; AC1NSYRC ...
MW:     452.459780 g/mol MF: C21H12N2O6S2
IUPAC name: 4-[5-[(Z)-[3-(4-nitrophenyl)-4-oxo-2-sulfanylidene-1,3-thiaz...
Create Date: 2005-07-28
CID: 5341808

3228. SU-11652; CHEMBL13485; SU11652 ...
MW:     414.928380 g/mol MF: C22H27ClN4O2
IUPAC name: 5-[(Z)-(5-chloro-2-oxo-1H-indol-3-ylidene)methyl]-N-[2-(diet...
Create Date: 2006-01-30
CID: 5329103

3229. 6-arylpyrido[2,3-d]pyrimidine deriv. 19; AC1NS3TN; PD089828 analog 8 ...
MW:     494.183120 g/mol MF: C18H18Br2N6O
IUPAC name: 1-[2-amino-6-(2,6-dibromophenyl)pyrido[2,3-d]pyrimidin-7-yl]...
Create Date: 2006-01-30
CID: 5328121

3230. AC1NS3G5; Acyclic Balanol Analog 29b; BDBM3199 ...
MW:     492.474060 g/mol MF: C27H24O9
IUPAC name: 2-[2,6-dihydroxy-4-[(1R,2S)-2-[(4-hydroxyphenyl)methyl]cyclo...
Create Date: 2006-01-30
CID: 5327958

3231. C49-METHYL RAPAMYCIN; Rapamycin C-7, analog 5b; BDBM36611
MW:     928.198440 g/mol MF: C52H81NO13
Create Date: 2005-06-24
CID: 5289261

3232. AC1NQSQP; benzenesulfonamide analog 22; CHEMBL196186 ...
MW:     685.896880 g/mol MF: C34H47N5O6S2
IUPAC name: (2S)-N-[(2S,3R)-3-hydroxy-4-[[3-(hydroxymethyl)phenyl]sulfon...
Create Date: 2005-10-07
CID: 5278371

3233. AC1NQSQM; benzenesulfonamide analog 19; CHEMBL193420 ...
MW:     685.896880 g/mol MF: C34H47N5O6S2
IUPAC name: (2S)-N-[(2S,3R)-3-hydroxy-4-[[4-(hydroxymethyl)phenyl]sulfon...
Create Date: 2005-10-07
CID: 5278368

3234. AC1NQSQJ; benzenesulfonamide analog 18; CHEMBL370301 ...
MW:     683.881000 g/mol MF: C34H45N5O6S2
IUPAC name: (2S)-N-[(2S,3R)-4-[(4-formylphenyl)sulfonyl-(2-methylpropyl)...
Create Date: 2005-10-07
CID: 5278367

3235. AC1NQSQG; benzenesulfonamide analog 17; CHEMBL435935 ...
MW:     681.908180 g/mol MF: C35H47N5O5S2
IUPAC name: (2S)-N-[(2S,3R)-4-[(4-ethenylphenyl)sulfonyl-(2-methylpropyl...
Create Date: 2005-10-07
CID: 5278366

3236. AC1NQSQA; benzenesulfonamide analog 15; CHEMBL195207 ...
MW:     698.895640 g/mol MF: C34H46N6O6S2
IUPAC name: 4-[[(2R,3S)-2-hydroxy-3-[[(2S)-3-methyl-2-[3-[(2-methyl-1,3-...
Create Date: 2005-10-07
CID: 5278364

3237. AC1NQSQ7; benzenesulfonamide analog 14; CHEMBL196175 ...
MW:     680.880360 g/mol MF: C34H44N6O5S2
IUPAC name: (2S)-N-[(2S,3R)-4-[(4-cyanophenyl)sulfonyl-(2-methylpropyl)a...
Create Date: 2005-10-07
CID: 5278363

3238. AC1NQSQ1; benzenesulfonamide analog 12; CHEMBL371279 ...
MW:     699.880400 g/mol MF: C34H45N5O7S2
IUPAC name: 4-[[(2R,3S)-2-hydroxy-3-[[(2S)-3-methyl-2-[3-[(2-methyl-1,3-...
Create Date: 2005-10-07
CID: 5278361

3239. AC1NQSPY; benzenesulfonamide analog 11; CHEMBL370010 ...
MW:     712.922220 g/mol MF: C35H48N6O6S2
IUPAC name: (2S)-N-[(2S,3R)-4-[(4-acetamidophenyl)sulfonyl-(2-methylprop...
Create Date: 2005-10-07
CID: 5278360

3240. AC1NQSPV; benzenesulfonamide analog 10; CHEMBL197470 ...
MW:     748.975920 g/mol MF: C34H48N6O7S3
IUPAC name: (2S)-N-[(2S,3R)-3-hydroxy-4-[[4-(methanesulfonamido)phenyl]s...
Create Date: 2005-10-07
CID: 5278359

3241. alpha-Descyclohexyl-alpha-phenyl Oxybutynin; 14943-53-4; UNII-Q22UJW0W32 ...
MW:     351.438800 g/mol MF: C22H25NO3
IUPAC name: 4-(diethylamino)but-2-ynyl 2-hydroxy-2,2-diphenylacetate
Create Date: 2005-09-17
CID: 4918064

3242. (S)-1-((S)-3,3-Dimethyl-2-((S)-2-(methylamino)propanamido)butanoyl)-N-((R)-1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine-2-carboxamide; 846550-95-6; N-METHYLALANYL-3-METHYLVALYL-N-(1,2,3,4-TETRAHYDRONAPHTHALEN-1-YL)PROLINAMIDE ...
MW:     442.594220 g/mol MF: C25H38N4O3
IUPAC name: (2S)-1-[(2S)-3,3-dimethyl-2-[[(2S)-2-(methylamino)propanoyl]...
Create Date: 2005-06-24
CID: 4369343

3243. N-heptyl-1,2,3,4-tetrahydroacridin-9-amine; AC1MJ7H0; alkylated Tacrine analogue 2 ...
MW:     296.449720 g/mol MF: C20H28N2
IUPAC name: N-heptyl-1,2,3,4-tetrahydroacridin-9-amine
Create Date: 2005-08-09
CID: 3087102

3244. ST070957; BAS 00744634; AC1M4DTH ...
MW:     475.460190 g/mol MF: C22H12F3NO4S2
IUPAC name: 4-[5-[(Z)-[4-oxo-2-sulfanylidene-3-[3-(trifluoromethyl)pheny...
Create Date: 2005-07-15
CID: 2256361

3245. CHEMBL2349217; 3-[(5Z)-5-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid; 3-[(5Z)-5-{[5-(4-nitrophenyl)furan-2-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid ...
MW:     404.416980 g/mol MF: C17H12N2O6S2
IUPAC name: 3-[(5Z)-5-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2...
Create Date: 2005-07-12
CID: 1641056

3246. 2-[(5Z)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid; 2-[(5Z)-5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid; rhodanine derivative, 3 ...
MW:     390.390400 g/mol MF: C16H10N2O6S2
IUPAC name: 2-[(5Z)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2...
Create Date: 2005-07-12
CID: 1611137

3247. 4-(4-bromophenoxy)benzene-1,2-dicarbonitrile; ZINC01266797; AC1LRIC3 ...
MW:     299.122180 g/mol MF: C14H7BrN2O
IUPAC name: 4-(4-bromophenoxy)benzene-1,2-dicarbonitrile
Create Date: 2005-07-11
CID: 1396778

3248. 4-[(5Z)-5-[[5-(4-bromophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid; 4-[(5Z)-5-{[5-(4-bromophenyl)furan-2-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid; AC1LQJOI ...
MW:     452.342060 g/mol MF: C18H14BrNO4S2
IUPAC name: 4-[(5Z)-5-[[5-(4-bromophenyl)furan-2-yl]methylidene]-4-oxo-2...
Create Date: 2005-07-11
CID: 1351628

3249. ST51015917; (5Z)-5-[[5-(4-bromo-3-chlorophenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one; (5Z)-5-{[5-(4-bromo-3-chlorophenyl)furan-2-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one ...
MW:     400.697880 g/mol MF: C14H7BrClNO2S2
IUPAC name: (5Z)-5-[[5-(4-bromo-3-chlorophenyl)furan-2-yl]methylidene]-2...
Create Date: 2005-07-11
CID: 1344086

3250. CHEMBL227618; (5Z)-5-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one; (5Z)-5-{[5-(3,4-dichlorophenyl)furan-2-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one ...
MW:     356.246880 g/mol MF: C14H7Cl2NO2S2
IUPAC name: (5Z)-5-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-2-sul...
Create Date: 2005-07-10
CID: 1268564

3251. Rhodanine-furan analogue 26; BDBM8461; CHEMBL200605 ...
MW:     345.392840 g/mol MF: C16H11NO4S2
IUPAC name: 2-[(5Z)-4-oxo-5-[(5-phenylfuran-2-yl)methylidene]-2-sulfanyl...
Create Date: 2005-07-10
CID: 1204542

3252. ZINC00190318; AC1LF48V; Phthalonitrile analogue, 4f ...
MW:     270.284800 g/mol MF: C18H10N2O
IUPAC name: 4-naphthalen-2-yloxybenzene-1,2-dicarbonitrile
Create Date: 2005-07-08
CID: 746636

3253. N-(3-fluorophenyl)quinazolin-4-amine; CHEMBL92985; ZINC00151212 ...
MW:     239.247703 g/mol MF: C14H10FN3
IUPAC name: N-(3-fluorophenyl)quinazolin-4-amine
Create Date: 2005-07-08
CID: 735124

3254. ST092265; 3-[1-(carboxymethyl)-5-(4-methylphenyl)pyrrol-2-yl]propanoic acid; 3-[1-(carboxymethyl)-5-(4-methylphenyl)-1H-pyrrol-2-yl]propanoic acid ...
MW:     287.310480 g/mol MF: C16H17NO4
IUPAC name: 3-[1-(carboxymethyl)-5-(4-methylphenyl)pyrrol-2-yl]propanoic...
Create Date: 2005-07-08
CID: 707445

3255. STK066764; 3-[1-(carboxymethyl)-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid; 3-[1-Carboxymethyl-5-(4-fluoro-phenyl)-1H-pyrrol-2-yl]-propionic acid ...
MW:     291.274363 g/mol MF: C15H14FNO4
IUPAC name: 3-[1-(carboxymethyl)-5-(4-fluorophenyl)pyrrol-2-yl]propanoic...
Create Date: 2005-06-04
CID: 650632

3256. Dihydro-IC9564; AC1LAWYL; Dihydro-analog of IC9564 ...
MW:     757.137200 g/mol MF: C46H80N2O6
IUPAC name: (3R,4S)-4-[8-[[(1S,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9...
Create Date: 2005-08-01
CID: 496915

3257. AC1LAQ3P; Analog of PME-6-Me-MAP; CHEMBL58985 ...
MW:     263.187622 g/mol MF: C8H14N3O5P
IUPAC name: 2-(2-amino-6-methylpyrimidin-4-yl)oxyethoxymethylphosphonic ...
Create Date: 2005-08-01
CID: 493047

3258. 4-amino-5-fluoro-1-[(2S,5R)-5-(hydroxymethyl)-2,5-dihydrothiophen-2-yl]pyrimidin-2-one; AC1LA73W; L-5Fd4C, thiophene analog ...
MW:     243.258003 g/mol MF: C9H10FN3O2S
IUPAC name: 4-amino-5-fluoro-1-[(2S,5R)-5-(hydroxymethyl)-2,5-dihydrothi...
Create Date: 2005-08-01
CID: 462901

3259. MEN 10992; diethyl(methyl)[?]one; AC1LA5PR ...
MW:     320.388300 g/mol MF: C19H20N4O
Create Date: 2005-08-01
CID: 462244

3260. 162152-12-7; 1H-Pyrrole-2-acetic acid, 3-(methoxycarbonyl)-4-phenyl-, methyl ester; Dimethyl 4-Phenyl-1H-pyrrole-2,3-dicarboxylate ...
MW:     273.283900 g/mol MF: C15H15NO4
IUPAC name: methyl 2-(2-methoxy-2-oxoethyl)-4-phenyl-1H-pyrrole-3-carbox...
Create Date: 2005-08-01
CID: 461175

3261. AC1L9TW2; Haloperidol Me2NPrNH analog; 4-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-1-[4-[3-(dimethylamino)propylamino]phenyl]butan-1-one ...
MW:     458.035940 g/mol MF: C26H36ClN3O2
IUPAC name: 4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-1-[4-[3-(dime...
Create Date: 2005-08-01
CID: 455924

3262. AC1L9TVW; Haloperidol Me2NEtNH analog; 4-[4-(4-Chlorophenyl)-4-hydroxypiperidino]-4'-[[2-(dimethylamino)ethyl]amino]butyrophenone ...
MW:     444.009360 g/mol MF: C25H34ClN3O2
IUPAC name: 4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-1-[4-[2-(dime...
Create Date: 2005-08-01
CID: 455922

3263. 114551-78-9; 3'-Azido-2',3'-dideoxy-5-aza-1-deazauridine; 2,4(1H,3H)-Pyrimidinedione, 5-(3-azido-2,3-dideoxy-beta-D-erythro-pentofuranosyl)- ...
MW:     253.214740 g/mol MF: C9H11N5O4
IUPAC name: 5-[(2R,4S,5S)-4-azido-5-(hydroxymethyl)oxolan-2-yl]-1H-pyrim...
Create Date: 2005-08-01
CID: 451848

3264. CHEMBL361054; 5-FLUORO-1-[4-(4-PHENYL-3,6-DIHYDROPYRIDIN-1(2H)-YL)BUTYL]QUINAZOLINE-2,4(1H,3H)-DIONE; FRQ ...
MW:     393.453963 g/mol MF: C23H24FN3O2
IUPAC name: 5-fluoro-1-[4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]qu...
Create Date: 2005-06-24
CID: 448890

3265. NSC677551; STK369768; NSC-677551 ...
MW:     424.580400 g/mol MF: C26H20N2S2
IUPAC name: N-[4-[[4-(benzylideneamino)phenyl]disulfanyl]phenyl]-1-pheny...
Create Date: 2005-03-26
CID: 386011

3266. 4-Phenoxyphthalonitrile; 38791-62-7; 4-Phenoxybenzene-1,2-dinitrile ...
MW:     220.226120 g/mol MF: C14H8N2O
IUPAC name: 4-phenoxybenzene-1,2-dicarbonitrile
Create Date: 2005-03-26
CID: 371800

3267. 1H-Pyrrole-2,4-dicarboxylic acid, 1,3,5-trimethyl-, diethyl ester; MLS000737829; 5462-32-8 ...
MW:     253.294260 g/mol MF: C13H19NO4
IUPAC name: diethyl 1,3,5-trimethylpyrrole-2,4-dicarboxylate
Create Date: 2005-03-26
CID: 226756

3268. Benzylcarbamyllidocaine; 5-benzyl-2-[(n,n-diethylglycyl)amino]-4-methyl-1h-pyrrole-3-carboxamide; AC1Q5LTI ...
MW:     342.435340 g/mol MF: C19H26N4O2
IUPAC name: 5-benzyl-2-[[2-(diethylamino)acetyl]amino]-4-methyl-1H-pyrro...
Create Date: 2005-08-09
CID: 194445

3269. ATX inhibitor 10 analogue 3; BDBM103573
MW:     477.405100 g/mol MF: C18H20Cl2N3O4S2-
IUPAC name: 4-[4-[(5Z)-5-[(3,4-dichlorophenyl)methylidene]-4-oxo-1,3-thi...
Create Date: 2015-10-07
CID: 91899654

3270. 3-aryl isoxazole analog, 7h; BDBM30343
MW:     552.405320 g/mol MF: C28H23Cl2N3O5
IUPAC name: 6-[4-[[5-(1-chloroethyl)-3-(3-chloro-6-oxo-1H-pyridin-2-yl)-...
Create Date: 2015-10-06
CID: 91896090

3271. 3-aryl isoxazole analog, 7g; BDBM30342
MW:     566.431900 g/mol MF: C29H25Cl2N3O5
IUPAC name: 6-[4-[[5-(1-chloroethyl)-3-(3-chloro-6-methoxypyridin-2-yl)-...
Create Date: 2015-10-06
CID: 91896089

3272. 3-aryl isoxazole analog, 7f; BDBM30341
MW:     566.431900 g/mol MF: C29H25Cl2N3O5
IUPAC name: 6-[4-[[5-(1-chloroethyl)-3-(3-chloro-1-methyl-6-oxopyridin-2...
Create Date: 2015-10-06
CID: 91896088

3273. 3-aryl isoxazole analog, 7e; BDBM30340
MW:     600.876960 g/mol MF: C29H24Cl3N3O5
IUPAC name: 6-[4-[[5-(1-chloroethyl)-3-(3,5-dichloro-1-methyl-2-oxopyrid...
Create Date: 2015-10-06
CID: 91896087

3274. 3-aryl isoxazole analog, 7d; BDBM30339
MW:     566.431900 g/mol MF: C29H25Cl2N3O5
IUPAC name: 6-[4-[[5-(1-chloroethyl)-3-(3-chloro-1-methyl-2-oxopyridin-4...
Create Date: 2015-10-06
CID: 91896086

3275. 3-aryl isoxazole analog, 7c; BDBM30338
MW:     552.405320 g/mol MF: C28H23Cl2N3O5
IUPAC name: 6-[4-[[5-(1-chloroethyl)-3-(3-chloro-2-oxo-1H-pyridin-4-yl)-...
Create Date: 2015-10-06
CID: 91896085

3276. 3-aryl isoxazole analog, 7b; BDBM30337
MW:     586.850380 g/mol MF: C28H22Cl3N3O5
IUPAC name: 6-[4-[[5-(1-chloroethyl)-3-(3,5-dichloro-1-oxidopyridin-1-iu...
Create Date: 2015-10-06
CID: 91896084

3277. 3-aryl isoxazole analog, 7a; BDBM30336
MW:     570.850980 g/mol MF: C28H22Cl3N3O4
IUPAC name: 6-[4-[[5-(1-chloroethyl)-3-(3,5-dichloropyridin-4-yl)-1,2-ox...
Create Date: 2015-10-06
CID: 91896083

3278. Homoisocitrate oxa analogue, 2; BDBM23213; trisodium (2S,3R)-2-(carboxylatomethoxy)-3-hydroxybutanedioate
MW:     205.099100 g/mol MF: C6H5O8-3
IUPAC name: (2S,3R)-2-(carboxylatomethoxy)-3-hydroxybutanedioate
Create Date: 2015-10-06
CID: 91895998

3279. PD 178390 Analog 8; BDBM2169; (3-(2-tert-Butyl-5-methyl-phenylsulfanyl)-4-hydroxy-6-[2-(4-hydroxy-phenyl)-ethyl]-6-cyclopentyl-5,6-dihydro-pyran-2-one ...
MW:     480.658740 g/mol MF: C29H36O4S
IUPAC name: 3-(2-tert-butyl-5-methylphenyl)sulfanyl-6-cyclopentyl-6-[2-(...
Create Date: 2015-10-06
CID: 91895576

3280. PD 178390 Analog 7; BDBM2168; (3-(2-tert-Butyl-5-methyl-phenylsulfanyl)-6-cyclopropyl-4-hydroxy-6-[2-(4-hydroxy-phenyl)-ethyl]-5,6-dihydro-pyran-2-one ...
MW:     452.605580 g/mol MF: C27H32O4S
IUPAC name: 3-(2-tert-butyl-5-methylphenyl)sulfanyl-6-cyclopropyl-6-[2-(...
Create Date: 2015-10-06
CID: 91895575

3281. PD 178390 Analog 6; BDBM2167; (3-(2-tert-Butyl-5-methyl-phenylsulfanyl)-4-hydroxy-6-[2-(4-hydroxy-phenyl)-ethyl]-6-isopropyl-5,6-dihydro-pyran-2-one ...
MW:     454.621460 g/mol MF: C27H34O4S
IUPAC name: 3-(2-tert-butyl-5-methylphenyl)sulfanyl-6-[2-(4-hydroxypheny...
Create Date: 2015-10-06
CID: 91895574

3282. PD 178390 Analog 5; BDBM2166; (3-(2-tert-Butyl-4-hydroxymethyl-5-methyl-phenylsulfanyl)-6-[2-(4-hydroxy-phenyl)-ethyl]-6-pentyl-5,6-dihydro-pyran-2-one ...
MW:     482.674620 g/mol MF: C29H38O4S
IUPAC name: 3-(2-tert-butyl-5-methylphenyl)sulfanyl-6-[2-(4-hydroxypheny...
Create Date: 2015-10-06
CID: 91895573

3283. PD 178390 Analog 4; BDBM2165; 6-Butyl-(3-(2-tert-Butyl-4-hydroxymethyl-5-methyl-phenylsulfanyl)-6-[2-(4-hydroxy-phenyl)-ethyl]-5,6-dihydro-pyran-2-one ...
MW:     468.648040 g/mol MF: C28H36O4S
IUPAC name: 6-butyl-3-(2-tert-butyl-5-methylphenyl)sulfanyl-6-[2-(4-hydr...
Create Date: 2015-10-06
CID: 91895572

3284. PD 178390 Analog 3; BDBM2164; (3-(2-tert-Butyl-5-methyl-phenylsulfanyl)-4-hydroxy-6-[2-(4-hydroxy-phenyl)-ethyl]-6-propyl-5,6-dihydro-pyran-2-one ...
MW:     454.621460 g/mol MF: C27H34O4S
IUPAC name: 3-(2-tert-butyl-5-methylphenyl)sulfanyl-6-[2-(4-hydroxypheny...
Create Date: 2015-10-06
CID: 91895571

3285. PD 178390 Analog 2; BDBM2163; 3-[(2-tert-butyl-5-methylphenyl)sulfanyl]-4-hydroxy-6-[2-(4-hydroxyphenyl)ethyl]-6-methyl-5,6-dihydro-2H-pyran-2-one
MW:     426.568300 g/mol MF: C25H30O4S
IUPAC name: 3-(2-tert-butyl-5-methylphenyl)sulfanyl-6-[2-(4-hydroxypheny...
Create Date: 2015-10-06
CID: 91895570

3286. mini-MbA analog inhibitor 10; BDBM163656; 3-O-(6-(4-(Caffeamidomethyl)-triazolyl)hexyl)quercetin ...
MW:     644.627980 g/mol MF: C33H32N4O10
IUPAC name: (E)-3-(3,4-dihydroxyphenyl)-N-[[1-[6-[2-(3,4-dihydroxyphenyl...
Create Date: 2015-06-25
CID: 91808057

3287. Fentanyl, 4-N-pentyl analogue; XBJSBLVYMJQONW-UHFFFAOYSA-N
MW:     302.454300 g/mol MF: C19H30N2O
IUPAC name: N-(1-pentylpiperidin-4-yl)-N-phenylpropanamide
Create Date: 2015-04-28
CID: 91753694

3288. Fentanyl, 4-N-octyl analogue; CGZZCMMWVRVQCD-UHFFFAOYSA-N
MW:     344.534040 g/mol MF: C22H36N2O
IUPAC name: N-(1-octylpiperidin-4-yl)-N-phenylpropanamide
Create Date: 2015-04-28
CID: 91753693

3289. Fentanyl, 4-N-nonyl analogue; ZWOWXODZUDOPQZ-UHFFFAOYSA-N
MW:     358.560620 g/mol MF: C23H38N2O
IUPAC name: N-(1-nonylpiperidin-4-yl)-N-phenylpropanamide
Create Date: 2015-04-28
CID: 91753692

3290. Fentanyl, 4-N-hexyl analogue; VUCBDKQCPHDWDV-UHFFFAOYSA-N
MW:     316.480880 g/mol MF: C20H32N2O
IUPAC name: N-(1-hexylpiperidin-4-yl)-N-phenylpropanamide
Create Date: 2015-04-28
CID: 91753691

3291. Fentanyl, 4-N-heptyl analogue; GKXBTMCVMRIGIY-UHFFFAOYSA-N
MW:     330.507460 g/mol MF: C21H34N2O
IUPAC name: N-(1-heptylpiperidin-4-yl)-N-phenylpropanamide
Create Date: 2015-04-28
CID: 91753690

3292. Fentanyl, 4-N-decyl analogue; ZVVBZVXZRBYMIC-UHFFFAOYSA-N
MW:     372.587200 g/mol MF: C24H40N2O
IUPAC name: N-(1-decylpiperidin-4-yl)-N-phenylpropanamide
Create Date: 2015-04-28
CID: 91753689

3293. Fentanyl, 4-N-butyl analogue; JSAWGYPPDVJYIV-UHFFFAOYSA-N
MW:     288.427720 g/mol MF: C18H28N2O
IUPAC name: N-(1-butylpiperidin-4-yl)-N-phenylpropanamide
Create Date: 2015-04-28
CID: 91753688

3294. PD 178390 Analog 9; BDBM2170; 3-[(2-tert-butyl-5-methylphenyl)sulfanyl]-6-cyclohexyl-4-hydroxy-6-[2-(4-hydroxyphenyl)ethyl]-5,6-dihydro-2H-pyran-2-one
MW:     494.685320 g/mol MF: C30H38O4S
IUPAC name: 3-(2-tert-butyl-5-methylphenyl)sulfanyl-6-cyclohexyl-6-[2-(4...
Create Date: 2015-03-17
CID: 90947507

3295. AppppA analog, 17 (X=S); BDBM81593
MW:     874.650646 g/mol MF: C23H29N10O15P3S3-4
IUPAC name: 2-(6-aminopurin-9-yl)-5-[[[3-[[5-(6-aminopurin-9-yl)-3,4-dih...
Create Date: 2014-07-24
CID: 76156259

3296. AppppA analog, 15 (X=S); BDBM81590
MW:    1124.884626 g/mol MF: C33H41N15O18P3S3-3
IUPAC name: 2-(6-aminopurin-9-yl)-5-[[2,3-bis[[[5-(6-aminopurin-9-yl)-3,...
Create Date: 2014-07-24
CID: 76156253

3297. AppppA analog, 14 (X=S); BDBM81588
MW:    1012.732828 g/mol MF: C25H32N10O18P4S4-6
IUPAC name: 2-(6-aminopurin-9-yl)-5-[[[2-[[[5-(6-aminopurin-9-yl)-3,4-di...
Create Date: 2014-07-24
CID: 76156249

3298. AppppA analog, 13 (X=S); BDBM81586
MW:    1513.200788 g/mol MF: C45H56N20O24P4S4-4
IUPAC name: 2-(6-aminopurin-9-yl)-5-[[[3-[[5-(6-aminopurin-9-yl)-3,4-dih...
Create Date: 2014-07-24
CID: 76156245

3299. AppppA analog, 12 (X=S); BDBM81584
MW:    1263.974748 g/mol MF: C35H45N15O21P4S4-4
IUPAC name: 2-(6-aminopurin-9-yl)-5-[[[2,2-bis[[[5-(6-aminopurin-9-yl)-3...
Create Date: 2014-07-24
CID: 76156241

3300. AppppA analog, 11 (X=S); BDBM81582
MW:     796.752824 g/mol MF: C23H30N10O10P2S4-2
IUPAC name: 2-(6-aminopurin-9-yl)-5-[[3-[[5-(6-aminopurin-9-yl)-3,4-dihy...
Create Date: 2014-07-24
CID: 76156237

3301. GP-L AnaloGue PARP inhibitor; W-3600
MW:     358.815543 g/mol MF: C15H16ClFN2O3S
IUPAC name: 2-(3-chloropropylsulfonyl)-8-fluoro-1,3,4,5-tetrahydrobenzo[...
Create Date: 2014-07-01
CID: 74892012

3302. ATX inhibitor 10 analogue 9; BDBM103579
MW:     428.332760 g/mol MF: C18H19Cl2N3O3S
IUPAC name: 4-[4-[(5Z)-5-[(3,4-dichlorophenyl)methylidene]-4-oxo-1,3-thi...
Create Date: 2014-01-18
CID: 72699326

3303. ATX inhibitor 10 analogue 8; BDBM103578
MW:     400.279600 g/mol MF: C16H15Cl2N3O3S
IUPAC name: 2-[4-[(5Z)-5-[(3,4-dichlorophenyl)methylidene]-4-oxo-1,3-thi...
Create Date: 2014-01-18
CID: 72699325

3304. ATX inhibitor 10 analogue 7; BDBM103577
MW:     476.375560 g/mol MF: C22H19Cl2N3O3S
IUPAC name: 4-[[4-[(5Z)-5-[(3,4-dichlorophenyl)methylidene]-4-oxo-1,3-th...
Create Date: 2014-01-18
CID: 72699324

3305. ATX inhibitor 10 analogue 6; BDBM103576
MW:     476.183800 g/mol MF: C21H20BCl2N3O3S
IUPAC name: [4-[[4-[(5Z)-5-[(3,4-dichlorophenyl)methylidene]-4-oxo-1,3-t...
Create Date: 2014-01-18
CID: 72699323

3306. ATX inhibitor 10 analogue 5; BDBM103575
MW:     476.183800 g/mol MF: C21H20BCl2N3O3S
IUPAC name: [3-[[4-[(5Z)-5-[(3,4-dichlorophenyl)methylidene]-4-oxo-1,3-t...
Create Date: 2014-01-18
CID: 72699322

3307. ATX inhibitor 10 analogue 2; BDBM103572
MW:     442.359340 g/mol MF: C19H21Cl2N3O3S
IUPAC name: 5-[4-[(5Z)-5-[(3,4-dichlorophenyl)methylidene]-4-oxo-1,3-thi...
Create Date: 2014-01-18
CID: 72699318

3308. ATX inhibitor 10 analogue 1; BDBM103571
MW:     342.243520 g/mol MF: C14H13Cl2N3OS
IUPAC name: (5Z)-5-[(3,4-dichlorophenyl)methylidene]-2-piperazin-1-yl-1,...
Create Date: 2014-01-18
CID: 72699317

3309. 1330171-51-1; Vardenafil Acetyl-d5 Analogue; DTXSID10858559 ...
MW:     471.606669 g/mol MF: C25H34N6O3
IUPAC name: 2-[2-ethoxy-5-[2-[4-(1,1,2,2,2-pentadeuterioethyl)piperazin-...
Create Date: 2013-11-01
CID: 71752930

3310. AANAT bisubstrate analog, 7; BDBM85114
MW:     968.821606 g/mol MF: C34H53N9O16P3S+
IUPAC name: 3-[2-[3-[[(2R)-4-[[[(2R,3S,4S)-5-(6-aminopurin-9-yl)-4-hydro...
Create Date: 2012-07-07
CID: 57339989

3311. AANAT bisubstrate analog, 6; BDBM85113
MW:     924.745866 g/mol MF: C32H47N8O16P3S
IUPAC name: [[(2R,3S,4S)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyo...
Create Date: 2012-07-07
CID: 57339988

3312. AANAT bisubstrate analog, 5; BDBM85112
MW:     938.772446 g/mol MF: C33H49N8O16P3S
IUPAC name: [[(2R,3S,4S)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyo...
Create Date: 2012-07-07
CID: 57339987

3313. AANAT bisubstrate analog, 4; BDBM85111
MW:     952.799026 g/mol MF: C34H51N8O16P3S
IUPAC name: [[(2R,3S,4S)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyo...
Create Date: 2012-07-07
CID: 57339986

3314. AANAT bisubstrate analog, 2; BDBM85110
MW:     983.813066 g/mol MF: C34H52N9O17P3S
IUPAC name: [[(2R,3S,4S)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyo...
Create Date: 2012-07-07
CID: 57339985

3315. AANAT bisubstrate analog, 1; BDBM85109
MW:     969.786486 g/mol MF: C33H50N9O17P3S
IUPAC name: [[(2R,3S,4S)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyo...
Create Date: 2012-07-07
CID: 57339984

3316. AANAT bisubstrate analog, 3; BDBM85108
MW:     980.809126 g/mol MF: C35H51N8O17P3S
IUPAC name: [[(2R,3S,4S)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyo...
Create Date: 2012-07-07
CID: 57339983

3317. Phosphate analogue, (S)-21; BDBM84560
MW:     197.083182 g/mol MF: C4H8NO6P
IUPAC name: [(4S)-2-oxo-1,3-oxazolidin-4-yl]methyl dihydrogen phosphate
Create Date: 2012-07-07
CID: 57339751

3318. Phosphate analogue, (s)-14; BDBM84559
MW:     213.082582 g/mol MF: C4H8NO7P
IUPAC name: [(4S)-3-hydroxy-2-oxo-1,3-oxazolidin-4-yl]methyl dihydrogen ...
Create Date: 2012-07-07
CID: 57339750

3319. Phosphoric acid, 2,5-dichloro-4-iodophenyl dimethyl ester; 7533-78-0; Iodofenoxon ...
MW:     396.930952 g/mol MF: C8H8Cl2IO4P
IUPAC name: (2,5-dichloro-4-iodophenyl) dimethyl phosphate
Create Date: 2012-03-21
CID: 56841920

3320. AppppA analog, 17 (X=O); BDBM81592
MW:     826.453846 g/mol MF: C23H29N10O18P3-4
IUPAC name: [1-[[(2R,3S,4R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-...
Create Date: 2011-12-15
CID: 54592258

3321. AppppA analog, 16 (X=S); BDBM81591
MW:    1122.915106 g/mol MF: C33H43N17O16P3S3-3
IUPAC name: (3R,4S,5R)-2-(6-aminopurin-9-yl)-5-[[[[2-[[(2R,3S,4R)-5-(6-a...
Create Date: 2011-12-15
CID: 54592256

3322. AppppA analog, 15 (X=O); BDBM81589
MW:    1076.687826 g/mol MF: C33H41N15O21P3-3
IUPAC name: [1-[[(2R,3S,4R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-...
Create Date: 2011-12-15
CID: 54592252

3323. AppppA analog, 14 (X=O); BDBM81587
MW:     948.470428 g/mol MF: C25H32N10O22P4-6
IUPAC name: [2-[[[(2R,3S,4R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2...
Create Date: 2011-12-15
CID: 54592248

3324. AppppA analog, 13 (X=O); BDBM81585
MW:    1448.938388 g/mol MF: C45H56N20O28P4-4
IUPAC name: [3-[[(3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-...
Create Date: 2011-12-15
CID: 54592244

3325. AppppA analog, 12 (X=O); BDBM81583
MW:    1199.712348 g/mol MF: C35H45N15O25P4-4
IUPAC name: [3-[[(3R,4S)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]...
Create Date: 2011-12-15
CID: 54592240

3326. AppppA analog, 10 (X=S); BDBM81581
MW:     762.652104 g/mol MF: C23H32N12O10P2S2-2
IUPAC name: (3R,4S,5R)-2-(6-aminopurin-9-yl)-5-[[[3-[[[(3S,4R,5R)-5-(6-a...
Create Date: 2011-12-15
CID: 54592236

3327. PD 178390 Analog 1; BDBM2517; 6-Phenyl-6-phenethyldihydropyrone 13f ...
MW:     488.637680 g/mol MF: C30H32O4S
IUPAC name: 3-(2-tert-butyl-5-methylphenyl)sulfanyl-6-[2-(4-hydroxypheny...
Create Date: 2011-12-04
CID: 54399142

3328. Piperidin-1-ium analog, 30; BDBM86558; 1-[2-(4-Chlorophenoxy)ethyl]-N-propylpiperidin-1-ium-3-carboxamide
MW:     325.853540 g/mol MF: C17H26ClN2O2+
IUPAC name: 1-[2-(4-chlorophenoxy)ethyl]-N-propylpiperidin-1-ium-3-carbo...
Create Date: 2011-09-06
CID: 53350247

3329. Rapamycin C-7, analog 17a; BDBM36628
MW:    1157.176510 g/mol MF: C57H81IN4O13
Create Date: 2011-04-25
CID: 51049460

3330. Rapamycin C-7, analog 16a; BDBM36627
MW:    1024.712880 g/mol MF: C57H82ClNO13
Create Date: 2011-04-25
CID: 51049459

3331. Rapamycin C-7, analog 15a; BDBM36626
MW:    1035.265380 g/mol MF: C57H82N2O15
Create Date: 2011-04-25
CID: 51049458

3332. Rapamycin C-7, analog 14a; BDBM36625
MW:     990.267820 g/mol MF: C57H83NO13
Create Date: 2011-04-25
CID: 51049457

3333. flufenamic acid analogue, 44; BDBM35918
MW:     403.351250 g/mol MF: C21H16F3NO4
IUPAC name: 2-[4-(2-methoxyphenoxy)-3-(trifluoromethyl)anilino]benzoic a...
Create Date: 2010-01-04
CID: 44521011

3334. flufenamic acid analogue, 40; BDBM35914
MW:     303.354480 g/mol MF: C20H17NO2
IUPAC name: 2-(3-benzylanilino)benzoic acid
Create Date: 2010-01-04
CID: 44521010

3335. flufenamic acid analogue, 39; BDBM35913
MW:     305.327300 g/mol MF: C19H15NO3
IUPAC name: 2-(2-phenoxyanilino)benzoic acid
Create Date: 2010-01-04
CID: 44521009

3336. flufenamic acid analogue, 38; BDBM35912
MW:     305.327300 g/mol MF: C19H15NO3
IUPAC name: 2-(3-phenoxyanilino)benzoic acid
Create Date: 2010-01-04
CID: 44521008

3337. Benzoic acid, 2-([1,1'-biphenyl]-3-ylamino)-; 21003-79-2; flufenamic acid analogue, 34 ...
MW:     289.327900 g/mol MF: C19H15NO2
IUPAC name: 2-(3-phenylanilino)benzoic acid
Create Date: 2010-01-04
CID: 44521007

3338. flufenamic acid analogue, 33; BDBM35906
MW:     403.351250 g/mol MF: C21H16F3NO4
IUPAC name: 2-[4-(4-methoxyphenoxy)-3-(trifluoromethyl)anilino]benzoic a...
Create Date: 2010-01-04
CID: 44521006

3339. flufenamic acid analogue, 31; BDBM35904
MW:     397.422660 g/mol MF: C25H19NO4
IUPAC name: 2-(3,5-diphenoxyanilino)benzoic acid
Create Date: 2010-01-04
CID: 44521005

3340. flufenamic acid analogue, 30; BDBM35903
MW:     321.392900 g/mol MF: C19H15NO2S
IUPAC name: 2-(2-phenylsulfanylanilino)benzoic acid
Create Date: 2010-01-04
CID: 44521004

3341. flufenamic acid analogue, 27; BDBM35900
MW:     306.315360 g/mol MF: C18H14N2O3
IUPAC name: 2-(4-pyridin-3-yloxyanilino)benzoic acid
Create Date: 2010-01-04
CID: 44521003

3342. flufenamic acid analogue, 26; BDBM35899
MW:     373.325270 g/mol MF: C20H14F3NO3
IUPAC name: 2-[4-phenoxy-3-(trifluoromethyl)anilino]benzoic acid
Create Date: 2010-01-04
CID: 44521002

3343. flufenamic acid analogue, 22; BDBM35895
MW:     327.374340 g/mol MF: C19H21NO4
IUPAC name: 2-(4-pentoxycarbonylanilino)benzoic acid
Create Date: 2010-01-04
CID: 44521001

3344. flufenamic acid analogue, 21; BDBM35894
MW:     323.317763 g/mol MF: C19H14FNO3
IUPAC name: 2-[4-(4-fluorophenoxy)anilino]benzoic acid
Create Date: 2010-01-04
CID: 44521000

3345. flufenamic acid analogue, 19; BDBM35892
MW:     319.353880 g/mol MF: C20H17NO3
IUPAC name: 2-[4-(4-methylphenoxy)anilino]benzoic acid
Create Date: 2010-01-04
CID: 44520999

3346. flufenamic acid analogue, 18; BDBM35891
MW:     297.391420 g/mol MF: C19H23NO2
IUPAC name: 2-(4-hexylanilino)benzoic acid
Create Date: 2010-01-04
CID: 44520998

3347. flufenamic acid analogue, 17; SCHEMBL4250051; BDBM35890
MW:     313.390820 g/mol MF: C19H23NO3
IUPAC name: 2-(4-hexoxyanilino)benzoic acid
Create Date: 2010-01-04
CID: 44520997

3348. flufenamic acid analogue, 16; BDBM35889
MW:     373.325270 g/mol MF: C20H14F3NO3
IUPAC name: 2-[4-[4-(trifluoromethyl)phenoxy]anilino]benzoic acid
Create Date: 2010-01-04
CID: 44520996

3349. flufenamic acid analogue, 15; BDBM35888; ZINC62260199 ...
MW:     321.392900 g/mol MF: C19H15NO2S
IUPAC name: 2-(4-phenylsulfanylanilino)benzoic acid
Create Date: 2010-01-04
CID: 44520995

3350. flufenamic acid analogue, 14; BDBM35887
MW:     350.324860 g/mol MF: C19H14N2O5
IUPAC name: 2-[4-(4-nitrophenoxy)anilino]benzoic acid
Create Date: 2010-01-04
CID: 44520994

3351. CHEMBL469135; 3-aryl isoxazole analog, 6d; BDBM30335
MW:     543.825640 g/mol MF: C27H21Cl3N2O4
IUPAC name: 3-[(E)-2-[2-chloro-4-[[3-(3,5-dichloropyridin-4-yl)-5-propan...
Create Date: 2009-08-19
CID: 44143575

3352. 3-aryl isoxazole analog, 6c; CHEMBL466318; BDBM30334
MW:     586.482900 g/mol MF: C29H25Cl2NO6S
IUPAC name: 3-[(E)-2-[2-chloro-4-[[3-(2-chloro-4-methylsulfonylphenyl)-5...
Create Date: 2009-08-19
CID: 44143574

3353. 3-aryl isoxazole analog, 6b; CHEMBL466315; BDBM30333
MW:     503.973440 g/mol MF: C29H26ClNO5
IUPAC name: 3-[(E)-2-[2-chloro-4-[[3-(2-methoxyphenyl)-5-propan-2-yl-1,2...
Create Date: 2009-08-19
CID: 44143573

3354. 2-aminopyridine analogue, 12; CHEMBL461583; BDBM28033 ...
MW:     528.891966 g/mol MF: C25H19ClF2N4O5
IUPAC name: N-[4-(2-amino-3-chloropyridin-4-yl)oxy-3-fluorophenyl]-1-(4-...
Create Date: 2009-04-13
CID: 25218746

3355. 2-aminopyridine analogue, 11; CHEMBL461582; BDBM28032 ...
MW:     526.919146 g/mol MF: C26H21ClF2N4O4
IUPAC name: N-[4-(2-amino-3-chloropyridin-4-yl)oxy-3-fluorophenyl]-1-(4-...
Create Date: 2009-04-13
CID: 25218745

3356. biphenyl diamine analogue, 26; BDBM27778; N-[2-amino-5-(4-fluorophenyl)phenyl]-4-{1,8-diazaspiro[4.5]decan-8-ylmethyl}benzamide
MW:     458.570343 g/mol MF: C28H31FN4O
IUPAC name: N-[2-amino-5-(4-fluorophenyl)phenyl]-4-(1,8-diazaspiro[4.5]d...
Create Date: 2009-04-13
CID: 25218559

3357. biphenyl diamine analogue, 25; CHEMBL473475; BDBM27777 ...
MW:     458.570343 g/mol MF: C28H31FN4O
IUPAC name: N-[2-amino-5-(3-fluorophenyl)phenyl]-4-(1,8-diazaspiro[4.5]d...
Create Date: 2009-04-13
CID: 25218558

3358. biphenyl diamine analogue, 24; CHEMBL473271; BDBM27776 ...
MW:     458.570343 g/mol MF: C28H31FN4O
IUPAC name: N-[2-amino-5-(2-fluorophenyl)phenyl]-4-(1,8-diazaspiro[4.5]d...
Create Date: 2009-04-13
CID: 25218557

3359. biphenyl diamine analogue, 23; CHEMBL514304; SCHEMBL1639760 ...
MW:     446.607600 g/mol MF: C26H30N4OS
IUPAC name: N-(2-amino-5-thiophen-3-ylphenyl)-4-(1,8-diazaspiro[4.5]deca...
Create Date: 2009-04-13
CID: 25218556

3360. biphenyl diamine analogue, 22; CHEMBL474890; SCHEMBL1640189 ...
MW:     446.607600 g/mol MF: C26H30N4OS
IUPAC name: N-(2-amino-5-thiophen-2-ylphenyl)-4-(1,8-diazaspiro[4.5]deca...
Create Date: 2009-04-13
CID: 25218555

3361. biphenyl diamine analogue, 20; CHEMBL513061; SCHEMBL1639718 ...
MW:     440.579880 g/mol MF: C28H32N4O
IUPAC name: N-(2-amino-5-phenylphenyl)-4-(2,8-diazaspiro[4.5]decan-8-ylm...
Create Date: 2009-04-13
CID: 25218554

3362. spiropiperidine analogue, 73; CHEMBL472086; BDBM26955 ...
MW:     557.597380 g/mol MF: C31H42Cl2N4O
IUPAC name: 3-[2-(butylamino)ethyl]-8-(6,7-dichloro-4,4-dimethyl-2,3-dih...
Create Date: 2009-03-16
CID: 25190630

3363. spiropiperidine analogue, 72; CHEMBL471880; BDBM26954 ...
MW:     523.152320 g/mol MF: C31H43ClN4O
IUPAC name: 3-[2-(butylamino)ethyl]-8-(6-chloro-4,4-dimethyl-2,3-dihydro...
Create Date: 2009-03-16
CID: 25190629

3364. spiropiperidine analogue, 71; CHEMBL511161; BDBM26953 ...
MW:     495.099160 g/mol MF: C29H39ClN4O
IUPAC name: 3-[2-(butylamino)ethyl]-8-(5-chloro-1,2,3,4-tetrahydronaphth...
Create Date: 2009-03-16
CID: 25190628

3365. spiropiperidine analogue, 70; CHEMBL516187; BDBM26952 ...
MW:     495.099160 g/mol MF: C29H39ClN4O
IUPAC name: 3-[2-(butylamino)ethyl]-8-(7-chloro-1,2,3,4-tetrahydronaphth...
Create Date: 2009-03-16
CID: 25190627

3366. spiropiperidine analogue, 69; CHEMBL511162; BDBM26951 ...
MW:     522.723480 g/mol MF: C34H42N4O
IUPAC name: 3-[2-(benzylamino)ethyl]-8-(4,4-dimethyl-2,3-dihydro-1H-naph...
Create Date: 2009-03-16
CID: 25190626

3367. spiropiperidine analogue, 68; CHEMBL471882; BDBM26950 ...
MW:     528.771120 g/mol MF: C34H48N4O
IUPAC name: 3-[2-(cyclohexylmethylamino)ethyl]-8-(4,4-dimethyl-2,3-dihyd...
Create Date: 2009-03-16
CID: 25190625

3368. spiropiperidine analogue, 67; CHEMBL515575; BDBM26946 ...
MW:     502.733840 g/mol MF: C32H46N4O
IUPAC name: 8-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-3-[2-(3-meth...
Create Date: 2009-03-16
CID: 25190623

3369. spiropiperidine analogue, 66; CHEMBL474096; BDBM26945 ...
MW:     488.707260 g/mol MF: C31H44N4O
IUPAC name: 3-[2-(butylamino)ethyl]-8-(4,4-dimethyl-2,3-dihydro-1H-napht...
Create Date: 2009-03-16
CID: 25190622

3370. spiropiperidine analogue, 65; CHEMBL473898; BDBM26944 ...
MW:     486.691380 g/mol MF: C31H42N4O
IUPAC name: 8-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-1-phenyl-3-(...
Create Date: 2009-03-16
CID: 25190621

3371. spiropiperidine analogue, 64; CHEMBL473280; BDBM26943 ...
MW:     516.760420 g/mol MF: C33H48N4O
IUPAC name: 8-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-3-[2-[di(pro...
Create Date: 2009-03-16
CID: 25190620

3372. spiropiperidine analogue, 63; CHEMBL473279; BDBM26942 ...
MW:     488.707260 g/mol MF: C31H44N4O
IUPAC name: 8-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-3-[2-(2-meth...
Create Date: 2009-03-16
CID: 25190619

3373. spiropiperidine analogue, 62; CHEMBL473278; BDBM26941 ...
MW:     486.691380 g/mol MF: C31H42N4O
IUPAC name: 3-[2-(cyclopropylmethylamino)ethyl]-8-(4,4-dimethyl-2,3-dihy...
Create Date: 2009-03-16
CID: 25190618

3374. spiropiperidine analogue, 61; CHEMBL474092; BDBM26940 ...
MW:     486.691380 g/mol MF: C31H42N4O
IUPAC name: 3-[2-(cyclobutylamino)ethyl]-8-(4,4-dimethyl-2,3-dihydro-1H-...
Create Date: 2009-03-16
CID: 25190617

3375. spiropiperidine analogue, 60; CHEMBL475094; BDBM26939 ...
MW:     472.664800 g/mol MF: C30H40N4O
IUPAC name: 8-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-1-phenyl-3-[...
Create Date: 2009-03-16
CID: 25190616

3376. spiropiperidine analogue, 59; CHEMBL473272; BDBM26938 ...
MW:     474.680680 g/mol MF: C30H42N4O
IUPAC name: 8-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-1-phenyl-3-[...
Create Date: 2009-03-16
CID: 25190615

3377. spiropiperidine analogue, 58; CHEMBL514463; BDBM26937 ...
MW:     514.744540 g/mol MF: C33H46N4O
IUPAC name: 3-[2-(cyclohexylamino)ethyl]-8-(4,4-dimethyl-2,3-dihydro-1H-...
Create Date: 2009-03-16
CID: 25190614

3378. spiropiperidine analogue, 57; CHEMBL515091; BDBM26936 ...
MW:     500.717960 g/mol MF: C32H44N4O
IUPAC name: 3-[2-(cyclopentylamino)ethyl]-8-(4,4-dimethyl-2,3-dihydro-1H...
Create Date: 2009-03-16
CID: 25190613

3379. spiropiperidine analogue, 56; CHEMBL514489; BDBM26935 ...
MW:     474.680680 g/mol MF: C30H42N4O
IUPAC name: 8-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-1-phenyl-3-[...
Create Date: 2009-03-16
CID: 25190612

3380. spiropiperidine analogue, 55; CHEMBL474687; BDBM26934 ...
MW:     460.654100 g/mol MF: C29H40N4O
IUPAC name: 8-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-3-[2-(ethyla...
Create Date: 2009-03-16
CID: 25190611

3381. spiropiperidine analogue, 54; CHEMBL474485; BDBM26933 ...
MW:     446.627520 g/mol MF: C28H38N4O
IUPAC name: 8-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-3-[2-(methyl...
Create Date: 2009-03-16
CID: 25190610

3382. spiropiperidine analogue, 53; CHEMBL474283; BDBM26932 ...
MW:     433.585700 g/mol MF: C27H35N3O2
IUPAC name: 8-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-3-(2-hydroxy...
Create Date: 2009-03-16
CID: 25190609

3383. spiropiperidine analogue, 52; CHEMBL511649; BDBM26931 ...
MW:     445.596400 g/mol MF: C28H35N3O2
IUPAC name: 8-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-3-(2-oxoprop...
Create Date: 2009-03-16
CID: 25190608

3384. spiropiperidine analogue, 51; CHEMBL471262; BDBM26930 ...
MW:     431.612880 g/mol MF: C28H37N3O
IUPAC name: 8-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-1-phenyl-3-p...
Create Date: 2009-03-16
CID: 25190607

3385. spiropiperidine analogue, 49; CHEMBL473701; BDBM26928 ...
MW:     489.480360 g/mol MF: C26H34Cl2N4O
IUPAC name: 8-[(2,6-dichlorophenyl)methyl]-3-[2-(diethylamino)ethyl]-1-p...
Create Date: 2009-03-16
CID: 25190606

3386. spiropiperidine analogue, 47; CHEMBL475310; BDBM26926 ...
MW:     489.480360 g/mol MF: C26H34Cl2N4O
IUPAC name: 8-[(2,6-dichlorophenyl)methyl]-3-[2-(2-methylpropylamino)eth...
Create Date: 2009-03-16
CID: 25190605

3387. spiropiperidine analogue, 46; CHEMBL514662; BDBM26925 ...
MW:     475.453780 g/mol MF: C25H32Cl2N4O
IUPAC name: 8-[(2,6-dichlorophenyl)methyl]-1-phenyl-3-[2-(propylamino)et...
Create Date: 2009-03-16
CID: 25190604

3388. spiropiperidine analogue, 45; CHEMBL516389; BDBM26924 ...
MW:     487.464480 g/mol MF: C26H32Cl2N4O
IUPAC name: 3-[2-(cyclobutylamino)ethyl]-8-[(2,6-dichlorophenyl)methyl]-...
Create Date: 2009-03-16
CID: 25190603

3389. spiropiperidine analogue, 44; CHEMBL472669; BDBM26923 ...
MW:     487.464480 g/mol MF: C26H32Cl2N4O
IUPAC name: 3-[2-(cyclopropylmethylamino)ethyl]-8-[(2,6-dichlorophenyl)m...
Create Date: 2009-03-16
CID: 25190602

3390. spiropiperidine analogue, 43; CHEMBL475707; BDBM26922 ...
MW:     475.453780 g/mol MF: C25H32Cl2N4O
IUPAC name: 8-[(2,6-dichlorophenyl)methyl]-1-phenyl-3-[2-(propan-2-ylami...
Create Date: 2009-03-16
CID: 25190601

3391. spiropiperidine analogue, 42; CHEMBL515142; BDBM26921 ...
MW:     461.427200 g/mol MF: C24H30Cl2N4O
IUPAC name: 8-[(2,6-dichlorophenyl)methyl]-3-[2-(ethylamino)ethyl]-1-phe...
Create Date: 2009-03-16
CID: 25190600

3392. spiropiperidine analogue, 41; CHEMBL517167; BDBM26920 ...
MW:     447.400620 g/mol MF: C23H28Cl2N4O
IUPAC name: 8-[(2,6-dichlorophenyl)methyl]-3-[2-(methylamino)ethyl]-1-ph...
Create Date: 2009-03-16
CID: 25190599

3393. CHEMBL240215; spiropiperidine analogue, 40; BDBM26919 ...
MW:     390.306240 g/mol MF: C20H21Cl2N3O
IUPAC name: 8-[(2,6-dichlorophenyl)methyl]-1-phenyl-1,3,8-triazaspiro[4....
Create Date: 2009-03-16
CID: 25190598

3394. spiropiperidine analogue, 39; CHEMBL464192; BDBM26918 ...
MW:     577.587020 g/mol MF: C33H38Cl2N4O
IUPAC name: 8-[bis(2-chlorophenyl)methyl]-1-phenyl-3-(2-piperidin-1-ylet...
Create Date: 2009-03-16
CID: 25190597

3395. spiropiperidine analogue, 38; CHEMBL464191; BDBM26917 ...
MW:     577.587020 g/mol MF: C33H38Cl2N4O
IUPAC name: 8-[bis(2-chlorophenyl)methyl]-1-phenyl-3-(3-pyrrolidin-1-ylp...
Create Date: 2009-03-16
CID: 25190596

3396. spiropiperidine analogue, 36; CHEMBL501088; BDBM26915 ...
MW:     605.640180 g/mol MF: C35H42Cl2N4O
IUPAC name: 8-[bis(2-chlorophenyl)methyl]-3-[2-(cyclohexylmethylamino)et...
Create Date: 2009-03-16
CID: 25190595

3397. spiropiperidine analogue, 35; CHEMBL457244; BDBM26914 ...
MW:     565.576320 g/mol MF: C32H38Cl2N4O
IUPAC name: 8-[bis(2-chlorophenyl)methyl]-3-[2-(2-methylpropylamino)ethy...
Create Date: 2009-03-16
CID: 25190594

3398. spiropiperidine analogue, 34; CHEMBL515829; BDBM26913 ...
MW:     565.576320 g/mol MF: C32H38Cl2N4O
IUPAC name: 8-[bis(2-chlorophenyl)methyl]-3-[2-(butylamino)ethyl]-1-phen...
Create Date: 2009-03-16
CID: 25190593

3399. spiropiperidine analogue, 33; CHEMBL499169; BDBM26912 ...
MW:     593.629480 g/mol MF: C34H42Cl2N4O
IUPAC name: 8-[bis(2-chlorophenyl)methyl]-3-[2-[di(propan-2-yl)amino]eth...
Create Date: 2009-03-16
CID: 25190592

3400. spiropiperidine analogue, 32; CHEMBL517265; BDBM26911 ...
MW:     549.533860 g/mol MF: C31H34Cl2N4O
IUPAC name: 8-[bis(2-chlorophenyl)methyl]-3-[2-(cyclopropylamino)ethyl]-...
Create Date: 2009-03-16
CID: 25190591

3401. spiropiperidine analogue, 31; CHEMBL460636; BDBM26910 ...
MW:     537.523160 g/mol MF: C30H34Cl2N4O
IUPAC name: 8-[bis(2-chlorophenyl)methyl]-3-[2-(dimethylamino)ethyl]-1-p...
Create Date: 2009-03-16
CID: 25190590

3402. spiropiperidine analogue, 30; CHEMBL510745; BDBM26909 ...
MW:     591.613600 g/mol MF: C34H40Cl2N4O
IUPAC name: 8-[bis(2-chlorophenyl)methyl]-3-[2-(cyclohexylamino)ethyl]-1...
Create Date: 2009-03-16
CID: 25190589

3403. spiropiperidine analogue, 29; CHEMBL456225; BDBM26908 ...
MW:     577.587020 g/mol MF: C33H38Cl2N4O
IUPAC name: 8-[bis(2-chlorophenyl)methyl]-3-[2-(cyclopentylamino)ethyl]-...
Create Date: 2009-03-16
CID: 25190588

3404. spiropiperidine analogue, 28; CHEMBL518325; BDBM26907 ...
MW:     551.549740 g/mol MF: C31H36Cl2N4O
IUPAC name: 8-[bis(2-chlorophenyl)methyl]-1-phenyl-3-[2-(propan-2-ylamin...
Create Date: 2009-03-16
CID: 25190587

3405. spiropiperidine analogue, 27; CHEMBL475096; BDBM26906 ...
MW:     537.523160 g/mol MF: C30H34Cl2N4O
IUPAC name: 8-[bis(2-chlorophenyl)methyl]-3-[2-(ethylamino)ethyl]-1-phen...
Create Date: 2009-03-16
CID: 25190586

3406. spiropiperidine analogue, 25; CHEMBL472867; BDBM26904 ...
MW:     509.470000 g/mol MF: C28H30Cl2N4O
IUPAC name: 3-(2-aminoethyl)-8-[bis(2-chlorophenyl)methyl]-1-phenyl-1,3,...
Create Date: 2009-03-16
CID: 25190585

3407. spiropiperidine analogue, 24; CHEMBL516024; BDBM26903 ...
MW:     524.481340 g/mol MF: C29H31Cl2N3O2
IUPAC name: 8-[bis(2-chlorophenyl)methyl]-3-(2-methoxyethyl)-1-phenyl-1,...
Create Date: 2009-03-16
CID: 25190584

3408. spiropiperidine analogue, 23; CHEMBL473884; BDBM26902 ...
MW:     510.454760 g/mol MF: C28H29Cl2N3O2
IUPAC name: 8-[bis(2-chlorophenyl)methyl]-3-(2-hydroxyethyl)-1-phenyl-1,...
Create Date: 2009-03-16
CID: 25190583

3409. spiropiperidine analogue, 22; CHEMBL516077; BDBM26901 ...
MW:     538.464860 g/mol MF: C29H29Cl2N3O3
IUPAC name: methyl 2-[8-[bis(2-chlorophenyl)methyl]-4-oxo-1-phenyl-1,3,8...
Create Date: 2009-03-16
CID: 25190582

3410. spiropiperidine analogue, 21; CHEMBL475497; BDBM26900 ...
MW:     536.535100 g/mol MF: C31H35Cl2N3O
IUPAC name: 8-[bis(2-chlorophenyl)methyl]-3-(3-methylbutyl)-1-phenyl-1,3...
Create Date: 2009-03-16
CID: 25190581

3411. spiropiperidine analogue, 20; CHEMBL475496; BDBM26899 ...
MW:     522.508520 g/mol MF: C30H33Cl2N3O
IUPAC name: 8-[bis(2-chlorophenyl)methyl]-3-butyl-1-phenyl-1,3,8-triazas...
Create Date: 2009-03-16
CID: 25190580

3412. spiropiperidine analogue, 19; CHEMBL514965; BDBM26898 ...
MW:     437.575940 g/mol MF: C29H31N3O
IUPAC name: 8-benzhydryl-1-phenyl-3-prop-2-enyl-1,3,8-triazaspiro[4.5]de...
Create Date: 2009-03-16
CID: 25190579

3413. spiropiperidine analogue, 18; CHEMBL474708; BDBM26897 ...
MW:     435.560060 g/mol MF: C29H29N3O
IUPAC name: 8-benzhydryl-1-phenyl-3-prop-2-ynyl-1,3,8-triazaspiro[4.5]de...
Create Date: 2009-03-16
CID: 25190578

3414. spiropiperidine analogue, 17; CHEMBL515554; BDBM26896 ...
MW:     493.682260 g/mol MF: C33H39N3O
IUPAC name: 8-benzhydryl-3-(cyclohexylmethyl)-1-phenyl-1,3,8-triazaspiro...
Create Date: 2009-03-16
CID: 25190577

3415. spiropiperidine analogue, 16; CHEMBL515901; BDBM26895 ...
MW:     465.629100 g/mol MF: C31H35N3O
IUPAC name: 8-benzhydryl-3-(cyclobutylmethyl)-1-phenyl-1,3,8-triazaspiro...
Create Date: 2009-03-16
CID: 25190576

3416. spiropiperidine analogue, 15; CHEMBL472677; BDBM26894 ...
MW:     451.602520 g/mol MF: C30H33N3O
IUPAC name: 8-benzhydryl-3-(cyclopropylmethyl)-1-phenyl-1,3,8-triazaspir...
Create Date: 2009-03-16
CID: 25190575

3417. spiropiperidine analogue, 13; CHEMBL514606; BDBM26892 ...
MW:     453.618400 g/mol MF: C30H35N3O
IUPAC name: 8-benzhydryl-3-butyl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-...
Create Date: 2009-03-16
CID: 25190574

3418. spiropiperidine analogue, 12; CHEMBL475308; BDBM26891 ...
MW:     439.591820 g/mol MF: C29H33N3O
IUPAC name: 8-benzhydryl-1-phenyl-3-propyl-1,3,8-triazaspiro[4.5]decan-4...
Create Date: 2009-03-16
CID: 25190573

3419. spiropiperidine analogue, 11; CHEMBL474091; BDBM26890 ...
MW:     425.565240 g/mol MF: C28H31N3O
IUPAC name: 8-benzhydryl-3-ethyl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-...
Create Date: 2009-03-16
CID: 25190572

3420. biphenyl diamine analogue, 19; SCHEMBL3678748; BDBM27771 ...
MW:     425.525480 g/mol MF: C26H27N5O
IUPAC name: N-(2-amino-5-phenylphenyl)-4-[[(1,5-dimethylpyrazol-4-yl)met...
Create Date: 2009-02-23
CID: 25158261

3421. biphenyl diamine analogue, 18; CHEMBL471466; SCHEMBL3642886 ...
MW:     408.494960 g/mol MF: C26H24N4O
IUPAC name: N-(2-amino-5-phenylphenyl)-4-[[methyl(pyridin-4-yl)amino]met...
Create Date: 2009-02-23
CID: 25157973

3422. biphenyl diamine analogue, 17; CHEMBL463788; SCHEMBL3643520 ...
MW:     394.468380 g/mol MF: C25H22N4O
IUPAC name: N-(2-amino-5-phenylphenyl)-4-[(pyridin-4-ylamino)methyl]benz...
Create Date: 2009-02-23
CID: 25157972

3423. Alkylpiperazine analogue, 44; CHEMBL503239; BDBM27563 ...
MW:     420.479303 g/mol MF: C24H25FN4O2
IUPAC name: 4-[[3-[4-(cyclopropylmethyl)piperazine-1-carbonyl]-4-fluorop...
Create Date: 2009-01-19
CID: 25133974

3424. Alkylpiperazine analogue, 43; CHEMBL493693; BDBM27562 ...
MW:     422.495183 g/mol MF: C24H27FN4O2
IUPAC name: 4-[[3-(4-butylpiperazine-1-carbonyl)-4-fluorophenyl]methyl]-...
Create Date: 2009-01-19
CID: 25133634

3425. Alkylpiperazine analogue, 42; CHEMBL493692; BDBM27561 ...
MW:     408.468603 g/mol MF: C23H25FN4O2
IUPAC name: 4-[[4-fluoro-3-(4-propylpiperazine-1-carbonyl)phenyl]methyl]...
Create Date: 2009-01-19
CID: 25133633

3426. Alkylpiperazine analogue, 41; CHEMBL492692; BDBM27560 ...
MW:     394.442023 g/mol MF: C22H23FN4O2
IUPAC name: 4-[[3-(4-ethylpiperazine-1-carbonyl)-4-fluorophenyl]methyl]-...
Create Date: 2009-01-19
CID: 25133632

3427. Alkylpiperazine analogue, 40; CHEMBL521815; SCHEMBL16190383 ...
MW:     380.415443 g/mol MF: C21H21FN4O2
IUPAC name: 4-[[4-fluoro-3-(4-methylpiperazine-1-carbonyl)phenyl]methyl]...
Create Date: 2009-01-19
CID: 25133631

3428. Alkylpiperazine analogue, 39; CHEMBL523829; BDBM27558 ...
MW:     362.424980 g/mol MF: C21H22N4O2
IUPAC name: 4-[[3-(4-methylpiperazine-1-carbonyl)phenyl]methyl]-2H-phtha...
Create Date: 2009-01-19
CID: 25133630

3429. 3-Cl-AHPC analogue, 11; CHEMBL460350; BDBM25132 ...
MW:     406.946060 g/mol MF: C20H19ClO3S2
IUPAC name: (E)-3-[3-chloro-4-[4-hydroxy-3-(2-methyl-1,3-dithian-2-yl)ph...
Create Date: 2008-11-14
CID: 25023783

3430. Benzisothiazole analogue, 17; CHEMBL527428; BDBM24530 ...
MW:     383.444120 g/mol MF: C18H13N3O3S2
IUPAC name: (5E)-2-(1,2-benzothiazol-3-ylamino)-5-[(4-hydroxy-3-methoxyp...
Create Date: 2008-10-21
CID: 24971249

3431. Benzisothiazole analogue, 16; CHEMBL486649; BDBM24529 ...
MW:     367.444720 g/mol MF: C18H13N3O2S2
IUPAC name: (5E)-2-(1,2-benzothiazol-3-ylamino)-5-[(4-methoxyphenyl)meth...
Create Date: 2008-10-21
CID: 24971248

3432. Benzothiazolyl- analogue, 15; CHEMBL520705; BDBM24528 ...
MW:     382.416300 g/mol MF: C17H10N4O3S2
IUPAC name: (5E)-2-(1,3-benzothiazol-2-ylamino)-5-[(3-nitrophenyl)methyl...
Create Date: 2008-10-21
CID: 24971247

3433. Benzothiazolyl- analogue, 14; CHEMBL488851; BDBM24527 ...
MW:     382.416300 g/mol MF: C17H10N4O3S2
IUPAC name: (5E)-2-(1,3-benzothiazol-2-ylamino)-5-[(4-nitrophenyl)methyl...
Create Date: 2008-10-21
CID: 24971246

3434. Benzothiazolyl- analogue, 13; CHEMBL528331; BDBM24526 ...
MW:     458.467660 g/mol MF: C19H14N4O6S2
IUPAC name: (5E)-5-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-2-[(6-ni...
Create Date: 2008-10-21
CID: 24971245

3435. Benzothiazolyl- analogue, 12; CHEMBL488850; BDBM24525 ...
MW:     413.470100 g/mol MF: C19H15N3O4S2
IUPAC name: (5E)-2-(1,3-benzothiazol-2-ylamino)-5-[(4-hydroxy-3,5-dimeth...
Create Date: 2008-10-21
CID: 24971244

3436. Benzothiazolyl- analogue, 11; CHEMBL504967; SCHEMBL16276320 ...
MW:     367.444720 g/mol MF: C18H13N3O2S2
IUPAC name: (5E)-2-(1,3-benzothiazol-2-ylamino)-5-[(4-methoxyphenyl)meth...
Create Date: 2008-10-21
CID: 24971243

3437. pyridine N-oxide analogue, 4; CHEMBL459875; SCHEMBL6326815 ...
MW:     440.425883 g/mol MF: C25H17FN4O3
IUPAC name: N-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]-1-ox...
Create Date: 2008-09-22
CID: 24901689

3438. T0901317 analogue, 4; BDBM21665; N-[4-(1,1,1-trifluoro-2-hydroxybutan-2-yl)phenyl]-N-(2,2,2-trifluoroethyl)benzenesulfonamide
MW:     441.387899 g/mol MF: C18H17F6NO3S
IUPAC name: N-(2,2,2-trifluoroethyl)-N-[4-(1,1,1-trifluoro-2-hydroxybuta...
Create Date: 2008-05-08
CID: 24776333

3439. Spiro-indolinone analogue, 9; CHEMBL409742; SCHEMBL2480424 ...
MW:     393.778440 g/mol MF: C17H16ClN3O6
IUPAC name: 2-[5-chloro-1'-[2-(dimethylamino)-2-oxoethyl]-2,2',5'-trioxo...
Create Date: 2008-05-08
CID: 24776281

3440. Spiro-indolinone analogue, 8; CHEMBL259453; BDBM21547 ...
MW:     377.323843 g/mol MF: C17H16FN3O6
IUPAC name: 2-[1'-[2-(dimethylamino)-2-oxoethyl]-5-fluoro-2,2',5'-trioxo...
Create Date: 2008-05-08
CID: 24776280

3441. Spiro-indolinone analogue, 7; CHEMBL264403; SCHEMBL2486417 ...
MW:     394.377420 g/mol MF: C21H18N2O6
IUPAC name: 2-(1'-benzyl-5-methoxy-2,2',5'-trioxospiro[indole-3,3'-pyrro...
Create Date: 2008-05-08
CID: 24776279

3442. Spiro-indolinone analogue, 6; CHEMBL261689; SCHEMBL2487487 ...
MW:     382.341903 g/mol MF: C20H15FN2O5
IUPAC name: 2-(1'-benzyl-5-fluoro-2,2',5'-trioxospiro[indole-3,3'-pyrrol...
Create Date: 2008-05-08
CID: 24776278

3443. pyrrolidine urea analogue, 20; CHEMBL378775; SCHEMBL17320578 ...
MW:     375.262960 g/mol MF: C17H19BrN4O
IUPAC name: 1-(2-bromophenyl)-3-[(3R)-1-(5-methylpyridin-2-yl)pyrrolidin...
Create Date: 2008-04-23
CID: 24768251

3444. pyrrolidine urea analogue, 19; CHEMBL210883; BDBM20508 ...
MW:     386.245840 g/mol MF: C17H16BrN5O
IUPAC name: 1-(2-bromophenyl)-3-[(3R)-1-(5-cyanopyridin-2-yl)pyrrolidin-...
Create Date: 2008-04-23
CID: 24768250

3445. pyrrolidine urea analogue, 18; CHEMBL207748; BDBM20507 ...
MW:     395.681440 g/mol MF: C16H16BrClN4O
IUPAC name: 1-(2-bromophenyl)-3-[(3R)-1-(5-chloropyridin-2-yl)pyrrolidin...
Create Date: 2008-04-23
CID: 24768249

3446. pyrrolidine urea analogue, 17; CHEMBL208522; BDBM20506 ...
MW:     440.132440 g/mol MF: C16H16Br2N4O
IUPAC name: 1-(2-bromophenyl)-3-[(3R)-1-(5-bromopyridin-2-yl)pyrrolidin-...
Create Date: 2008-04-23
CID: 24768248

3447. pyrrolidine urea analogue, 16; CHEMBL206867; BDBM20505 ...
MW:     429.234350 g/mol MF: C17H16BrF3N4O
IUPAC name: 1-(2-bromophenyl)-3-[(3R)-1-[6-(trifluoromethyl)pyridin-2-yl...
Create Date: 2008-04-23
CID: 24768247

3448. pyrrolidine urea analogue, 14; CHEMBL377868; BDBM20503 ...
MW:     429.234350 g/mol MF: C17H16BrF3N4O
IUPAC name: 1-(2-bromophenyl)-3-[(3R)-1-[4-(trifluoromethyl)pyridin-2-yl...
Create Date: 2008-04-23
CID: 24768246

3449. pyrrolidine urea analogue, 13; CHEMBL209980; BDBM20502 ...
MW:     429.234350 g/mol MF: C17H16BrF3N4O
IUPAC name: 1-(2-bromophenyl)-3-[(3R)-1-[3-(trifluoromethyl)pyridin-2-yl...
Create Date: 2008-04-23
CID: 24768245

3450. pyrrolidine urea analogue, 12; CHEMBL210142; BDBM20501 ...
MW:     361.236380 g/mol MF: C16H17BrN4O
IUPAC name: 1-(2-bromophenyl)-3-[(3R)-1-pyridin-2-ylpyrrolidin-3-yl]urea
Create Date: 2008-04-23
CID: 24768244

3451. biphenyl diamine analogue, 21; CHEMBL475692; SCHEMBL1639796 ...
MW:     440.579880 g/mol MF: C28H32N4O
IUPAC name: N-(2-amino-5-phenylphenyl)-4-(1,8-diazaspiro[4.5]decan-8-ylm...
Create Date: 2008-03-10
CID: 24746277

3452. Geldampicin; Geldanamycin, rifamycin analog; NSC210754 ...
MW:     685.807540 g/mol MF: C35H51N5O9
IUPAC name: [(3S,5S,6R,7S,8E,10S,11R,12Z,14E,19Z)-6-hydroxy-5,11,21-trim...
Create Date: 2008-02-29
CID: 24196091

3453. chlamydocin-epoxide analog, 2; BDBM19157; (3S,9S,14aR)-9-benzyl-6,6-dimethyl-3-[5-(oxiran-2-yl)pentyl]-tetradecahydropyrrolo[1,2-a][,,,]cyclododecane-1,4,7,10-tetrone
MW:     498.614420 g/mol MF: C27H38N4O5
IUPAC name: (3S,9S,12R)-3-benzyl-6,6-dimethyl-9-[5-(oxiran-2-yl)pentyl]-...
Create Date: 2008-01-19
CID: 23648189

3454. Diaminopyrimidine analogue, 3; BDBM18223; 6-{3-[(2,4-diaminopyrimidin-5-yl)methyl]-4,5-dimethoxyphenyl}hex-5-ynoic acid
MW:     370.402380 g/mol MF: C19H22N4O4
IUPAC name: 6-[3-[(2,4-diaminopyrimidin-5-yl)methyl]-4,5-dimethoxyphenyl...
Create Date: 2008-01-19
CID: 23647975

3455. pyrazolopyridine analog, 25d; CHEMBL226383; BDBM16797 ...
MW:     421.493720 g/mol MF: C26H23N5O
IUPAC name: (2S)-1-phenyl-3-[5-(3-phenyl-1H-pyrazolo[3,4-c]pyridin-5-yl)...
Create Date: 2008-01-19
CID: 23647443

3456. pyrazolopyridine analog, 25c; CHEMBL375486; BDBM16796 ...
MW:     424.497660 g/mol MF: C25H24N6O
IUPAC name: (2S)-1-[5-[3-(1-methylpyrrol-2-yl)-1H-pyrazolo[3,4-c]pyridin...
Create Date: 2008-01-19
CID: 23647442

3457. pyrazolopyridine analog, 25b; CHEMBL375485; BDBM16795 ...
MW:     411.455840 g/mol MF: C24H21N5O2
IUPAC name: (2S)-1-[5-[3-(furan-2-yl)-1H-pyrazolo[3,4-c]pyridin-5-yl]pyr...
Create Date: 2008-01-19
CID: 23647441

3458. pyrazolopyridine analog, 25a; CHEMBL226382; BDBM16794 ...
MW:     371.435040 g/mol MF: C22H21N5O
IUPAC name: (2S)-1-[5-(3-ethenyl-1H-pyrazolo[3,4-c]pyridin-5-yl)pyridin-...
Create Date: 2008-01-19
CID: 23647440

3459. Pyrrole Carboxamide Analog 6q; CHEMBL220574; BDBM15646 ...
MW:     459.300383 g/mol MF: C22H17Cl2FN4O2
IUPAC name: (4Z)-N-[(1R)-1-(3-chloro-4-fluorophenyl)-2-hydroxyethyl]-4-[...
Create Date: 2008-01-19
CID: 23647178

3460. N-(1-(3-chloro-4-fluorophenyl)-2-hydroxyethyl)-4-(4-(3-chlorophenyl)-1H-pyrazol-3-yl)-1H-pyrrole-2-carboxamide; N-[1-(3-chloro-4-fluorophenyl)-2-hydroxyethyl]-4-[4-(3-chlorophenyl)-1H-pyrazol-3-yl]-1H-pyrrole-2-carboxamide; C22H17Cl2FN4O2 ...
MW:     459.300383 g/mol MF: C22H17Cl2FN4O2
IUPAC name: (4Z)-N-[1-(3-chloro-4-fluorophenyl)-2-hydroxyethyl]-4-[4-(3-...
Create Date: 2008-01-19
CID: 23647177

3461. 4-(4-(3-chlorophenyl)-1H-pyrazol-3-yl)-N-(1-(3,5-dichlorophenyl)-2-hydroxyethyl)-1H-pyrrole-2-carboxamide; 4-[4-(3-chlorophenyl)-1H-pyrazol-3-yl]-N-[1-(3,5-dichlorophenyl)-2-hydroxyethyl]-1H-pyrrole-2-carboxamide; Pyrrole Carboxamide Analog 6n ...
MW:     475.754980 g/mol MF: C22H17Cl3N4O2
IUPAC name: (4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]-N-[...
Create Date: 2008-01-19
CID: 23647176

3462. 4-(4-(3-chlorophenyl)-1H-pyrazol-3-yl)-N-(1-(3,4-difluorophenyl)-2-hydroxyethyl)-1H-pyrrole-2-carboxamide; 4-[4-(3-chlorophenyl)-1H-pyrazol-3-yl]-N-[1-(3,4-difluorophenyl)-2-hydroxyethyl]-1H-pyrrole-2-carboxamide; Pyrrole Carboxamide Analog 6m ...
MW:     442.845786 g/mol MF: C22H17ClF2N4O2
IUPAC name: (4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]-N-[...
Create Date: 2008-01-19
CID: 23647175

3463. 4-(4-(3-chlorophenyl)-1H-pyrazol-3-yl)-N-(1-(3-fluorophenyl)-2-hydroxyethyl)-1H-pyrrole-2-carboxamide; 4-[4-(3-chlorophenyl)-1H-pyrazol-3-yl]-N-[1-(3-fluorophenyl)-2-hydroxyethyl]-1H-pyrrole-2-carboxamide; Pyrrole Carboxamide Analog 6l ...
MW:     424.855323 g/mol MF: C22H18ClFN4O2
IUPAC name: (4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]-N-[...
Create Date: 2008-01-19
CID: 23647174

3464. 4-(4-(3-chlorophenyl)-1H-pyrazol-3-yl)-N-(1-(2-fluorophenyl)-2-hydroxyethyl)-1H-pyrrole-2-carboxamide; 4-[4-(3-chlorophenyl)-1H-pyrazol-3-yl]-N-[1-(2-fluorophenyl)-2-hydroxyethyl]-1H-pyrrole-2-carboxamide; Pyrrole Carboxamide Analog 6k ...
MW:     424.855323 g/mol MF: C22H18ClFN4O2
IUPAC name: (4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]-N-[...
Create Date: 2008-01-19
CID: 23647173

3465. Pyrrole Carboxamide Analog 6j; CHEMBL222465; BDBM15639 ...
MW:     474.862830 g/mol MF: C23H18ClF3N4O2
IUPAC name: (4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]-N-[...
Create Date: 2008-01-19
CID: 23647172

3466. 4-(4-(3-chlorophenyl)-1H-pyrazol-3-yl)-N-(1-(4-chlorophenyl)-2-hydroxyethyl)-1H-pyrrole-2-carboxamide; 4-[4-(3-chlorophenyl)-1H-pyrazol-3-yl]-N-[1-(4-chlorophenyl)-2-hydroxyethyl]-1H-pyrrole-2-carboxamide; Pyrrole Carboxamide Analog 6i ...
MW:     441.309920 g/mol MF: C22H18Cl2N4O2
IUPAC name: (4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]-N-[...
Create Date: 2008-01-19
CID: 23647171

3467. 4-(4-(3-chlorophenyl)-1H-pyrazol-3-yl)-N-(1-(4-fluorophenyl)-2-hydroxyethyl)-1H-pyrrole-2-carboxamide; 4-[4-(3-chlorophenyl)-1H-pyrazol-3-yl]-N-[1-(4-fluorophenyl)-2-hydroxyethyl]-1H-pyrrole-2-carboxamide; Pyrrole Carboxamide Analog 6h ...
MW:     424.855323 g/mol MF: C22H18ClFN4O2
IUPAC name: (4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]-N-[...
Create Date: 2008-01-19
CID: 23647170

3468. Pyrrole Carboxamide Analog 6g; CHEMBL220174; BDBM15636 ...
MW:     418.875560 g/mol MF: C23H19ClN4O2
IUPAC name: (4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]-N-(...
Create Date: 2008-01-19
CID: 23647169

3469. Pyrrole Carboxamide Analog 6f; CHEMBL220096; BDBM15635 ...
MW:     433.890200 g/mol MF: C23H20ClN5O2
IUPAC name: (4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]-N-[...
Create Date: 2008-01-19
CID: 23647168

3470. Pyrrole Carboxamide Analog 6e; CHEMBL220888; BDBM15634 ...
MW:     419.863620 g/mol MF: C22H18ClN5O2
IUPAC name: (4Z)-N-[(1S)-2-amino-2-oxo-1-phenylethyl]-4-[4-(3-chlorophen...
Create Date: 2008-01-19
CID: 23647167

3471. Pyrrole Carboxamide Analog 6d; CHEMBL219627; BDBM15633 ...
MW:     420.848380 g/mol MF: C22H17ClN4O3
IUPAC name: (2S)-2-[[(4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-yli...
Create Date: 2008-01-19
CID: 23647166

3472. Pyrrole Carboxamide Analog 6c; CHEMBL220112; BDBM15632 ...
MW:     406.864860 g/mol MF: C22H19ClN4O2
IUPAC name: (4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]-N-[...
Create Date: 2008-01-19
CID: 23647165

3473. Pyrrole Carboxamide Analog 6b; CHEMBL221117; BDBM15631 ...
MW:     390.865460 g/mol MF: C22H19ClN4O
IUPAC name: (4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]-N-[...
Create Date: 2008-01-19
CID: 23647164

3474. Pyrrole Carboxamide Analog 6a; CHEMBL373628; BDBM15630 ...
MW:     390.865460 g/mol MF: C22H19ClN4O
IUPAC name: (4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]-N-[...
Create Date: 2008-01-19
CID: 23647163

3475. Pyrrole Carboxamide Analog 5o; CHEMBL220272; BDBM15629 ...
MW:     392.838280 g/mol MF: C21H17ClN4O2
IUPAC name: (4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]-N-p...
Create Date: 2008-01-19
CID: 23647162

3476. Pyrrole Carboxamide Analog 5n; CHEMBL373448; BDBM15628 ...
MW:     391.853520 g/mol MF: C21H18ClN5O
IUPAC name: (4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]-N-(...
Create Date: 2008-01-19
CID: 23647161

3477. Pyrrole Carboxamide Analog 5m; CHEMBL375621; BDBM15627 ...
MW:     402.876160 g/mol MF: C23H19ClN4O
IUPAC name: [(4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]pyr...
Create Date: 2008-01-19
CID: 23647160

3478. Pyrrole Carboxamide Analog 5l; CHEMBL223471; BDBM15626 ...
MW:     406.864860 g/mol MF: C22H19ClN4O2
IUPAC name: (4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]-N-[...
Create Date: 2008-01-19
CID: 23647159

3479. Pyrrole Carboxamide Analog 5k; CHEMBL222249; BDBM15625 ...
MW:     412.819806 g/mol MF: C21H15ClF2N4O
IUPAC name: (4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]-N-[...
Create Date: 2008-01-19
CID: 23647158

3480. N-Benzyl-4-(4-(3-chlorophenyl)-1H-pyrazol-3-yl)-N-methyl-1H-pyrrole-2-carboxamide; N-benzyl-4-[4-(3-chlorophenyl)-1H-pyrazol-3-yl]-N-methyl-1H-pyrrole-2-carboxamide; Pyrrole Carboxamide Analog 5j ...
MW:     390.865460 g/mol MF: C22H19ClN4O
IUPAC name: (4Z)-N-benzyl-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-yli...
Create Date: 2008-01-19
CID: 23647157

3481. Pyrrole Carboxamide Analog 5i; CHEMBL221109; BDBM15623 ...
MW:     377.826940 g/mol MF: C20H16ClN5O
IUPAC name: (4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]-N-(...
Create Date: 2008-01-19
CID: 23647156

3482. Pyrrole Carboxamide Analog 5h; CHEMBL220343; BDBM15622 ...
MW:     377.826940 g/mol MF: C20H16ClN5O
IUPAC name: (4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]-N-(...
Create Date: 2008-01-19
CID: 23647155

3483. 2oji; Pyrrole Carboxamide Analog 5g; CHEMBL220320 ...
MW:     376.838880 g/mol MF: C21H17ClN4O
IUPAC name: (4Z)-N-benzyl-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-yli...
Create Date: 2008-01-19
CID: 23647154

3484. 4-(4-(3-chlorophenyl)-1H-pyrazol-3-yl)-N-phenyl-1H-pyrrole-2-carboxamide; 4-[4-(3-chlorophenyl)-1H-pyrazol-3-yl]-N-phenyl-1H-pyrrole-2-carboxamide; Pyrrole Carboxamide Analog 5f ...
MW:     362.812300 g/mol MF: C20H15ClN4O
IUPAC name: (4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]-N-p...
Create Date: 2008-01-19
CID: 23647153

3485. 4-(4-(3-chlorophenyl)-1H-pyrazol-3-yl)-N-((1-ethylpyrrolidin-2-yl)methyl)-1H-pyrrole-2-carboxamide; 4-[4-(3-chlorophenyl)-1H-pyrazol-3-yl]-N-[(1-ethylpyrrolidin-2-yl)methyl]-1H-pyrrole-2-carboxamide; Pyrrole Carboxamide Analog 5e ...
MW:     397.901160 g/mol MF: C21H24ClN5O
IUPAC name: (4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]-N-[...
Create Date: 2008-01-19
CID: 23647152

3486. Pyrrole Carboxamide Analog 5d; CHEMBL219683; BDBM15618 ...
MW:     370.832760 g/mol MF: C19H19ClN4O2
IUPAC name: (4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]-N-(...
Create Date: 2008-01-19
CID: 23647151

3487. Pyrrole Carboxamide Analog 5c; CHEMBL374876; BDBM15617 ...
MW:     356.806180 g/mol MF: C18H17ClN4O2
IUPAC name: [(4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]pyr...
Create Date: 2008-01-19
CID: 23647150

3488. Pyrrole Carboxamide Analog 5b; CHEMBL220110; BDBM15616 ...
MW:     340.806780 g/mol MF: C18H17ClN4O
IUPAC name: [(4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]pyr...
Create Date: 2008-01-19
CID: 23647149

3489. 4-(4-(3-chlorophenyl)-1H-pyrazol-3-yl)-N-ethyl-N-methyl-1H-pyrrole-2-carboxamide; 4-[4-(3-chlorophenyl)-1H-pyrazol-3-yl]-N-ethyl-N-methyl-1H-pyrrole-2-carboxamide; Pyrrole Carboxamide Analog 5a ...
MW:     328.796080 g/mol MF: C17H17ClN4O
IUPAC name: (4Z)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]-N-e...
Create Date: 2008-01-19
CID: 23647148

3490. Monocyclic thiophene analog 8; CHEMBL212289; SCHEMBL3916316 ...
MW:     278.280500 g/mol MF: C13H10O5S
IUPAC name: 3-(carboxymethoxy)-4-phenylthiophene-2-carboxylic acid
Create Date: 2008-01-19
CID: 23646661

3491. Monocyclic thiophene analog 7; CHEMBL445320; SCHEMBL3918620 ...
MW:     216.211120 g/mol MF: C8H8O5S
IUPAC name: 3-(carboxymethoxy)-4-methylthiophene-2-carboxylic acid
Create Date: 2008-01-19
CID: 23646660

3492. alpha-ketothiazole analogue 13; BDBM12953; (2S)-N-[(2S)-5-carbamimidamido-1-oxo-1-(1,3-thiazol-2-yl)pentan-2-yl]-3-methyl-2-[(2S)-3-phenyl-2-[1-(thiophen-2-yl)acetamido]propanamido]butanamide
MW:     611.778580 g/mol MF: C29H37N7O4S2
IUPAC name: (2S)-N-[(2S)-5-(diaminomethylideneamino)-1-oxo-1-(1,3-thiazo...
Create Date: 2008-01-19
CID: 23646328

3493. sulfonylphenylamino analogue 8b; SCHEMBL14427358; BDBM11443 ...
MW:     364.849780 g/mol MF: C16H17ClN4O2S
IUPAC name: 5-chloro-N-(4-methylsulfonylphenyl)-3-propan-2-ylpyrazolo[1,...
Create Date: 2008-01-19
CID: 23645575

3494. lysine sulfonamide analogue 39; BDBM10178; (2S)-N-[(5R)-5-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-6-hydroxyhexyl]-2-[(4-hydroxy-3-nitrophenyl)formamido]-3,3-diphenylpropanamide
MW:     731.857600 g/mol MF: C38H45N5O8S
IUPAC name: N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino...
Create Date: 2008-01-19
CID: 23645101

3495. lysine sulfonamide analogue 38; BDBM10177; (2S)-N-[(5R)-5-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-6-hydroxyhexyl]-2-[(3-hydroxy-4-nitrophenyl)formamido]-3,3-diphenylpropanamide
MW:     731.857600 g/mol MF: C38H45N5O8S
IUPAC name: N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino...
Create Date: 2008-01-19
CID: 23645100

3496. lysine sulfonamide analogue 37; BDBM10176; (2S)-N-[(5R)-5-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-6-hydroxyhexyl]-2-[(4-hydroxyphenyl)formamido]-3,3-diphenylpropanamide
MW:     686.860040 g/mol MF: C38H46N4O6S
IUPAC name: N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino...
Create Date: 2008-01-19
CID: 23645099

3497. lysine sulfonamide analogue 36; BDBM10175; (2S)-N-[(5R)-5-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-6-hydroxyhexyl]-2-[(3-hydroxyphenyl)formamido]-3,3-diphenylpropanamide
MW:     686.860040 g/mol MF: C38H46N4O6S
IUPAC name: N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino...
Create Date: 2008-01-19
CID: 23645098

3498. lysine sulfonamide analogue 14; SCHEMBL2779644; BDBM10153 ...
MW:     566.754580 g/mol MF: C31H42N4O4S
IUPAC name: (2S)-2-amino-N-[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)a...
Create Date: 2008-01-19
CID: 23645097

3499. lysine sulfonamide analogue 11; SCHEMBL2781161; BDBM10147 ...
MW:     598.753380 g/mol MF: C31H42N4O6S
IUPAC name: methyl N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropy...
Create Date: 2008-01-19
CID: 23645096

3500. lysine sulfonamide analogue 10; SCHEMBL2779136; BDBM10146 ...
MW:     598.753380 g/mol MF: C31H42N4O6S
IUPAC name: methyl N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropy...
Create Date: 2008-01-19
CID: 23645095

3501. lysine sulfonamide analogue 35; BDBM10174; (2S)-N-[(5R)-5-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-6-hydroxyhexyl]-2-[(2-hydroxyphenyl)formamido]-3,3-diphenylpropanamide
MW:     686.860040 g/mol MF: C38H46N4O6S
IUPAC name: N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino...
Create Date: 2008-01-19
CID: 23645023

3502. lysine sulfonamide analogue 34; SCHEMBL2780066; BDBM10173 ...
MW:     701.874680 g/mol MF: C38H47N5O6S
IUPAC name: pyridin-4-ylmethyl N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2...
Create Date: 2008-01-19
CID: 23644967

3503. lysine sulfonamide analogue 33; SCHEMBL2780385; BDBM10172 ...
MW:     701.874680 g/mol MF: C38H47N5O6S
IUPAC name: pyridin-3-ylmethyl N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2...
Create Date: 2008-01-19
CID: 23644966

3504. lysine sulfonamide analogue 32; SCHEMBL2780669; BDBM10171 ...
MW:     701.874680 g/mol MF: C38H47N5O6S
IUPAC name: pyridin-2-ylmethyl N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2...
Create Date: 2008-01-19
CID: 23644965

3505. lysine sulfonamide analogue 31; SCHEMBL2781202; BDBM10170 ...
MW:     685.875280 g/mol MF: C38H47N5O5S
IUPAC name: (2S)-N-[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-6-...
Create Date: 2008-01-19
CID: 23644964

3506. lysine sulfonamide analogue 29; BDBM10168; (2S)-N-[(5R)-5-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-6-hydroxyhexyl]-2-[(6-aminopyridin-3-yl)formamido]-3,3-diphenylpropanamide
MW:     686.863340 g/mol MF: C37H46N6O5S
IUPAC name: 6-amino-N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylprop...
Create Date: 2008-01-19
CID: 23644963

3507. lysine sulfonamide analogue 28; BDBM10167; (2S)-N-[(5R)-5-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-6-hydroxyhexyl]-2-[(3-hydroxypyridin-2-yl)formamido]-3,3-diphenylpropanamide
MW:     687.848100 g/mol MF: C37H45N5O6S
IUPAC name: N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino...
Create Date: 2008-01-19
CID: 23644962

3508. lysine sulfonamide analogue 27; BDBM10166; (2S)-N-[(5R)-5-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-6-hydroxyhexyl]-2-[(6-methylpyridin-3-yl)formamido]-3,3-diphenylpropanamide
MW:     685.875280 g/mol MF: C38H47N5O5S
IUPAC name: N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino...
Create Date: 2008-01-19
CID: 23644961

3509. lysine sulfonamide analogue 26; BDBM10165; (2S)-N-[(5R)-5-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-6-hydroxyhexyl]-2-[(2-methylpyridin-3-yl)formamido]-3,3-diphenylpropanamide
MW:     685.875280 g/mol MF: C38H47N5O5S
IUPAC name: N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino...
Create Date: 2008-01-19
CID: 23644960

3510. lysine sulfonamide analogue 25; BDBM10164; (2S)-N-[(5R)-5-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-6-hydroxyhexyl]-3,3-diphenyl-2-(pyridin-4-ylformamido)propanamide
MW:     671.848700 g/mol MF: C37H45N5O5S
IUPAC name: N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino...
Create Date: 2008-01-19
CID: 23644959

3511. lysine sulfonamide analogue 24; BDBM10163; (2S)-N-[(5R)-5-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-6-hydroxyhexyl]-3,3-diphenyl-2-(pyridin-3-ylformamido)propanamide
MW:     671.848700 g/mol MF: C37H45N5O5S
IUPAC name: N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino...
Create Date: 2008-01-19
CID: 23644958

3512. lysine sulfonamide analogue 23; BDBM10162; (2S)-N-[(5R)-5-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-6-hydroxyhexyl]-3,3-diphenyl-2-(pyridin-2-ylformamido)propanamide
MW:     671.848700 g/mol MF: C37H45N5O5S
IUPAC name: N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino...
Create Date: 2008-01-19
CID: 23644957

3513. lysine sulfonamide analogue 21; BDBM10160; (2S)-N-[(5R)-5-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-6-hydroxyhexyl]-2-(1$l;{4},4-pyrazin-1-ylcarbonylamino)-3,3-diphenylpropanamide
MW:     673.844700 g/mol MF: C36H45N6O5S+
IUPAC name: N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino...
Create Date: 2008-01-19
CID: 23644956

3514. lysine sulfonamide analogue 20; BDBM10159; (2S)-N-[(5R)-5-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-6-hydroxyhexyl]-2-(morpholin-4-ylcarbonylamino)-3,3-diphenylpropanamide
MW:     679.869160 g/mol MF: C36H49N5O6S
IUPAC name: N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino...
Create Date: 2008-01-19
CID: 23644955

3515. lysine sulfonamide analogue 18; BDBM10157; tert-butyl N-[(1S)-1-{[(5R)-5-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-6-hydroxyhexyl]carbamoyl}-2,2-diphenylethyl]carbamate
MW:     666.870400 g/mol MF: C36H50N4O6S
IUPAC name: tert-butyl N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylp...
Create Date: 2008-01-19
CID: 23644954

3516. lysine sulfonamide analogue 17; BDBM10156; (2S)-N-[(5R)-5-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-6-hydroxyhexyl]-2-(cyclohexylformamido)-3,3-diphenylpropanamide
MW:     676.908280 g/mol MF: C38H52N4O5S
IUPAC name: N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino...
Create Date: 2008-01-19
CID: 23644930

3517. Homodimeric Tacrine Analog 4b; BDBM9060; CHEMBL307908 ...
MW:     520.750660 g/mol MF: C35H44N4
IUPAC name: N,N'-bis(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)...
Create Date: 2008-01-19
CID: 23644782

3518. Homodimeric Tacrine Analog 4a; BDBM9059; CHEMBL308962 ...
MW:     506.724080 g/mol MF: C34H42N4
IUPAC name: N,N'-bis(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)...
Create Date: 2008-01-19
CID: 23644781

3519. CHEMBL75985; Homodimeric Tacrine Analog 3m; BDBM9058 ...
MW:     508.700200 g/mol MF: C32H40N6
IUPAC name: N,N'-bis(6,7,8,9-tetrahydrobenzo[b][1,8]naphthyridin-5-yl)oc...
Create Date: 2008-01-19
CID: 23644780

3520. CHEMBL76173; Homodimeric Tacrine Analog 3k; BDBM9057 ...
MW:     494.673620 g/mol MF: C31H38N6
IUPAC name: N,N'-bis(6,7,8,9-tetrahydrobenzo[b][1,8]naphthyridin-5-yl)he...
Create Date: 2008-01-19
CID: 23644779

3521. CHEMBL75305; Homodimeric Tacrine Analog 3j; BDBM9056 ...
MW:     480.647040 g/mol MF: C30H36N6
IUPAC name: N,N'-bis(6,7,8,9-tetrahydrobenzo[b][1,8]naphthyridin-5-yl)he...
Create Date: 2008-01-19
CID: 23644778

3522. CHEMBL73160; Homodimeric Tacrine Analog 3g; BDBM9053 ...
MW:     547.561040 g/mol MF: C32H36Cl2N4
IUPAC name: N,N'-bis(6-chloro-1,2,3,4-tetrahydroacridin-9-yl)hexane-1,6-...
Create Date: 2008-01-19
CID: 23644777

3523. CHEMBL74940; Homodimeric Tacrine Analog 3d; BDBM9050 ...
MW:     514.651846 g/mol MF: C32H36F2N4
IUPAC name: N,N'-bis(6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)hexane-1,6-...
Create Date: 2008-01-19
CID: 23644776

3524. CHEMBL74827; Homodimeric Tacrine Analog 2c; BDBM9046 ...
MW:     478.670920 g/mol MF: C32H38N4
IUPAC name: N,N'-bis(2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)octane-1,...
Create Date: 2008-01-19
CID: 23644775

3525. CHEMBL76014; Homodimeric Tacrine Analog 2b; BDBM9045 ...
MW:     464.644340 g/mol MF: C31H36N4
IUPAC name: N,N'-bis(2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)heptane-1...
Create Date: 2008-01-19
CID: 23644774

3526. lysine sulfonamide analogue 40; BDBM10179; (2S)-N-[(5R)-5-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-6-hydroxyhexyl]-2-[(4-hydroxy-3-methoxyphenyl)formamido]-3,3-diphenylpropanamide
MW:     716.886020 g/mol MF: C39H48N4O7S
IUPAC name: N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino...
Create Date: 2008-01-19
CID: 23644634

3527. lysine sulfonamide analogue 30; BDBM10169; (2S)-N-[(5R)-5-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-6-hydroxyhexyl]-2-[(6-hydroxypyridin-3-yl)formamido]-3,3-diphenylpropanamide
MW:     687.848100 g/mol MF: C37H45N5O6S
IUPAC name: N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino...
Create Date: 2008-01-19
CID: 23644633

3528. lysine sulfonamide analogue 22; BDBM10161; (2S)-N-[(5R)-5-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-6-hydroxyhexyl]-3,3-diphenyl-2-(1H-pyrrol-2-ylformamido)propanamide
MW:     659.838000 g/mol MF: C36H45N5O5S
IUPAC name: N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino...
Create Date: 2008-01-19
CID: 23644632

3529. lysine sulfonamide analogue 19; SCHEMBL2782374; BDBM10158 ...
MW:     637.832480 g/mol MF: C34H47N5O5S
IUPAC name: (2S)-N-[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-6-...
Create Date: 2008-01-19
CID: 23644631

3530. lysine sulfonamide analogue 16; BDBM10155; (2S)-N-[(5R)-5-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-6-hydroxyhexyl]-2-(cyclopropylformamido)-3,3-diphenylpropanamide
MW:     634.828540 g/mol MF: C35H46N4O5S
IUPAC name: N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino...
Create Date: 2008-01-19
CID: 23644630

3531. lysine sulfonamide analogue 15; SCHEMBL2778124; BDBM10154 ...
MW:     608.791260 g/mol MF: C33H44N4O5S
IUPAC name: (2S)-2-acetamido-N-[5-[(4-aminophenyl)sulfonyl-(2-methylprop...
Create Date: 2008-01-19
CID: 23644629

3532. lysine sulfonamide analogue 12; SCHEMBL2777090; BDBM10148 ...
MW:     624.790660 g/mol MF: C33H44N4O6S
IUPAC name: methyl N-[(2S)-1-[[5-[(4-aminophenyl)sulfonyl-(2-methylpropy...
Create Date: 2008-01-19
CID: 23644626

3533. Homodimeric Tacrine Analog 4c; BDBM9061; CHEMBL306492 ...
MW:     534.777240 g/mol MF: C36H46N4
IUPAC name: N,N'-bis(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)...
Create Date: 2008-01-19
CID: 23644605

3534. 3-Cl-AHPC analogue, 12; CHEMBL460351; SCHEMBL12257895 ...
MW:     372.885100 g/mol MF: C22H25ClO3
IUPAC name: (E)-3-[3-chloro-4-[3-(3-ethylpentan-3-yl)-4-hydroxyphenyl]ph...
Create Date: 2007-12-07
CID: 23577107

3535. flufenamic acid analogue, 20; BDBM35893
MW:     303.354480 g/mol MF: C20H17NO2
IUPAC name: 2-(4-benzylanilino)benzoic acid
Create Date: 2007-12-06
CID: 23404644

3536. spiropiperidine analogue, 48; CHEMBL473700; BDBM26927 ...
MW:     489.480360 g/mol MF: C26H34Cl2N4O
IUPAC name: 3-[2-(butylamino)ethyl]-8-[(2,6-dichlorophenyl)methyl]-1-phe...
Create Date: 2007-12-06
CID: 23383556

3537. PSTQ Analog, 3{1,2}; SCHEMBL8021786; BDBM93390 ...
MW:     339.371720 g/mol MF: C16H13N5O2S
IUPAC name: 3-(benzenesulfonyl)-N-methyltriazolo[1,5-a]quinazolin-5-amin...
Create Date: 2007-12-05
CID: 22423856

3538. PSTQ Analog, 3{8,4}; BDBM93400; MolPort-019-714-906 ...
MW:     409.504620 g/mol MF: C21H23N5O2S
IUPAC name: N-butan-2-yl-3-(2,5-dimethylphenyl)sulfonyltriazolo[1,5-a]qu...
Create Date: 2007-12-05
CID: 20878529

3539. PSTQ Analog, 3{9,9}; BDBM93358; MolPort-007-662-005 ...
MW:     457.547420 g/mol MF: C25H23N5O2S
IUPAC name: 3-(3,4-dimethylphenyl)sulfonyl-N-(2-phenylethyl)triazolo[1,5...
Create Date: 2007-12-05
CID: 20878490

3540. PSTQ Analog, 3{1,4}; SCHEMBL8030468; BDBM93392 ...
MW:     381.451460 g/mol MF: C19H19N5O2S
IUPAC name: 3-(benzenesulfonyl)-N-butan-2-yltriazolo[1,5-a]quinazolin-5-...
Create Date: 2007-12-05
CID: 20878443

3541. flufenamic acid analogue, 36; CHEMBL2042450; SCHEMBL10983488 ...
MW:     319.353880 g/mol MF: C20H17NO3
IUPAC name: 2-(3-phenylmethoxyanilino)benzoic acid
Create Date: 2007-12-05
CID: 20262575

3542. flufenamic acid analogue, 23; SCHEMBL9501833; BDBM35896
MW:     305.327300 g/mol MF: C19H15NO3
IUPAC name: 2-(4-phenoxyanilino)benzoic acid
Create Date: 2007-12-05
CID: 19839536

3543. alpha-ketothiazole analogue 14; BDBM12954; (2S)-N-[(2S)-5-carbamimidamido-1-oxo-1-(1,3-thiazol-2-yl)pentan-2-yl]-2-[(2S)-2-[(3,4-dichlorobenzene)sulfonamido]-3-phenylpropanamido]-3-methylbutanamide
MW:     696.668100 g/mol MF: C29H35Cl2N7O5S2
IUPAC name: (2S)-N-[(2S)-5-(diaminomethylideneamino)-1-oxo-1-(1,3-thiazo...
Create Date: 2007-06-18
CID: 16098894

3544. alpha-ketothiazole analogue 12; BDBM12952; (2S)-N-[(2S)-5-carbamimidamido-1-oxo-1-(1,3-thiazol-2-yl)pentan-2-yl]-2-[(2S)-2-(furan-2-ylformamido)-3-phenylpropanamido]-3-methylbutanamide
MW:     581.686400 g/mol MF: C28H35N7O5S
IUPAC name: N-[(2S)-1-[[(2S)-1-[[(2S)-5-(diaminomethylideneamino)-1-oxo-...
Create Date: 2007-06-18
CID: 16098892

3545. alpha-ketothiazole analogue 11; BDBM12951; (2S)-N-[(2S)-5-carbamimidamido-1-oxo-1-(1,3-thiazol-2-yl)pentan-2-yl]-3-methyl-2-[(2S)-3-phenyl-2-[(phenylcarbamoyl)amino]propanamido]butanamide
MW:     606.738920 g/mol MF: C30H38N8O4S
IUPAC name: (2S)-N-[(2S)-5-(diaminomethylideneamino)-1-oxo-1-(1,3-thiazo...
Create Date: 2007-06-18
CID: 16098891

3546. alpha-ketothiazole analogue 10; BDBM12950; ethyl 2-({[(1S)-1-{[(1S)-1-{[(2S)-5-carbamimidamido-1-oxo-1-(1,3-thiazol-2-yl)pentan-2-yl]carbamoyl}-2-methylpropyl]carbamoyl}-2-phenylethyl]carbamoyl}amino)-4-methylpentanoate
MW:     672.838520 g/mol MF: C32H48N8O6S
IUPAC name: ethyl 2-[[(2S)-1-[[(2S)-1-[[(2S)-5-(diaminomethylideneamino)...
Create Date: 2007-06-18
CID: 16098890

3547. alpha-ketothiazole analogue 7; CHEMBL270204; BDBM12946 ...
MW:     689.655620 g/mol MF: C31H38Cl2N8O4S
IUPAC name: (2S)-N-[(2S)-5-(diaminomethylideneamino)-1-oxo-1-(1,3-thiazo...
Create Date: 2007-06-18
CID: 16098887

3548. GSK579289A; GSK 461364 analogue I; GTPL8150 ...
MW:     511.035580 g/mol MF: C26H27ClN4O3S
IUPAC name: 3-[(1R)-1-(2-chlorophenyl)ethoxy]-5-[6-(1-methylpiperidin-4-...
Create Date: 2007-05-07
CID: 16051023

3549. GSK 461364 analogue II; SCHEMBL2977519; CHEMBL1615278 ...
MW:     544.588490 g/mol MF: C27H27F3N4O3S
IUPAC name: 5-[6-(1-methylpiperidin-4-yl)oxybenzimidazol-1-yl]-3-[(1R)-1...
Create Date: 2007-05-07
CID: 16050925

3550. Spiro-indolinone analogue, 5; CHEMBL410333; SCHEMBL2484990 ...
MW:     398.796500 g/mol MF: C20H15ClN2O5
IUPAC name: 2-(1'-benzyl-5-chloro-2,2',5'-trioxospiro[indole-3,3'-pyrrol...
Create Date: 2007-03-07
CID: 15950271

3551. 2ojj; Pyrrole Carboxamide Analog 6p; BDBM15645 ...
MW:     459.300383 g/mol MF: C22H17Cl2FN4O2
IUPAC name: (4Z)-N-[(1S)-1-(3-chloro-4-fluorophenyl)-2-hydroxyethyl]-4-[...
Create Date: 2007-02-23
CID: 15942697

3552. 2-Thiophenecarboxylic acid, 3-(carboxymethoxy)-; 3-(carboxymethoxy)thiophene-2-carboxylic acid; 96232-58-5 ...
MW:     202.184540 g/mol MF: C7H6O5S
IUPAC name: 3-(carboxymethoxy)thiophene-2-carboxylic acid
Create Date: 2007-02-12
CID: 15588112

3553. Homodimeric Tacrine Analog 2a; BDBM9044; CHEMBL421501 ...
MW:     450.617760 g/mol MF: C30H34N4
IUPAC name: N,N'-bis(2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)hexane-1,...
Create Date: 2007-02-09
CID: 15490813

3554. Propanamide, N-phenyl-N-[1-(2-propenyl)-4-piperidinyl]-; 22261-97-8; Fentanyl, 4-N-allyl analogue ...
MW:     272.385260 g/mol MF: C17H24N2O
IUPAC name: N-phenyl-N-(1-prop-2-enylpiperidin-4-yl)propanamide
Create Date: 2007-02-09
CID: 15075634

3555. flufenamic acid analogue, 24; BDBM35897; ZINC39123556 ...
MW:     326.227470 g/mol MF: C14H9F3N2O4
IUPAC name: 2-[4-nitro-3-(trifluoromethyl)anilino]benzoic acid
Create Date: 2007-02-07
CID: 12323957

3556. flufenamic acid analogue, 45; SCHEMBL2712137; BDBM35919 ...
MW:     289.327900 g/mol MF: C19H15NO2
IUPAC name: 2-(2-phenylanilino)benzoic acid
Create Date: 2007-02-07
CID: 12166386

3557. P3 pyridyl oxazole analog 10; BDBM9152; SCHEMBL5257634 ...
MW:     780.832390 g/mol MF: C40H47F3N6O7
IUPAC name: (2S)-1-[(2S,4R)-4-benzyl-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4...
Create Date: 2007-02-07
CID: 12108566

3558. 57975-93-6; 2-((4-(Trifluoromethyl)phenyl)amino)benzoic acid; N-(4-(TRIFLUOROMETHYL)PHENYL)ANTHRANILIC ACID ...
MW:     281.229910 g/mol MF: C14H10F3NO2
IUPAC name: 2-[4-(trifluoromethyl)anilino]benzoic acid
Create Date: 2007-02-07
CID: 12058323

3559. CGS 27023A Analog 7; CHEMBL82558; SCHEMBL7343903 ...
MW:     304.337783 g/mol MF: C12H17FN2O4S
IUPAC name: 2-[(4-fluorophenyl)sulfonyl-(2-methylpropyl)amino]-N-hydroxy...
Create Date: 2006-10-26
CID: 11779797

3560. A313326 Analogue 40; CHEMBL347942; BDBM13401 ...
MW:     453.489220 g/mol MF: C27H23N3O4
IUPAC name: 4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-3...
Create Date: 2006-10-26
CID: 11775366

3561. (S)-5-(2-phenoxymethyl-azetidine-1-sulfonyl)-1H-indole-2,3-dione; Azetidine Isatin Analogue 17; CHEMBL200767 ...
MW:     372.395040 g/mol MF: C18H16N2O5S
IUPAC name: 5-[(2S)-2-(phenoxymethyl)azetidin-1-yl]sulfonyl-1H-indole-2,...
Create Date: 2006-10-26
CID: 11624920

3562. A313326 Analogue 48; CHEMBL156862; BDBM13404 ...
MW:     468.934240 g/mol MF: C27H21ClN4O2
IUPAC name: 4-[[(3-chloro-4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]...
Create Date: 2006-10-26
CID: 11454168

3563. A313326 Analogue 25; CHEMBL160563; BDBM13390 ...
MW:     448.515760 g/mol MF: C28H24N4O2
IUPAC name: 4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-3...
Create Date: 2006-10-26
CID: 11453686

3564. A313326 Analogue 49; CHEMBL160619; BDBM13405 ...
MW:     456.898723 g/mol MF: C26H18ClFN4O
IUPAC name: 3-(3-chlorophenyl)-4-[[(4-cyano-3-fluorophenyl)-(3-methylimi...
Create Date: 2006-10-26
CID: 11442467

3565. A313326 Analogue 28; CHEMBL157782; BDBM13393 ...
MW:     488.460570 g/mol MF: C27H19F3N4O2
IUPAC name: 4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-3...
Create Date: 2006-10-26
CID: 11431774

3566. A313326 Analogue 17; CHEMBL348861; BDBM13381 ...
MW:     455.509940 g/mol MF: C29H21N5O
IUPAC name: 4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-3...
Create Date: 2006-10-26
CID: 11430983

3567. A313326 Analogue 52; CHEMBL157581; BDBM13408 ...
MW:     452.934840 g/mol MF: C27H21ClN4O
IUPAC name: 3-(3-chlorophenyl)-4-[[(4-cyanophenyl)-(2,3-dimethylimidazol...
Create Date: 2006-10-26
CID: 11430910

3568. A313326 Analogue 29; CHEMBL345130; BDBM13394 ...
MW:     418.489780 g/mol MF: C27H22N4O
IUPAC name: 4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-3...
Create Date: 2006-10-26
CID: 11430037

3569. A313326 Analogue 61; CHEMBL156629; BDBM13415 ...
MW:     469.485346 g/mol MF: C27H21F2N5O
IUPAC name: 4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-3...
Create Date: 2006-10-26
CID: 11419991

3570. A313326 Analogue 39; CHEMBL156061; BDBM13400 ...
MW:     467.515800 g/mol MF: C28H25N3O4
IUPAC name: methyl 4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]me...
Create Date: 2006-10-26
CID: 11419954

3571. CCT018159 analog 10; CHEMBL190182; BDBM15371 ...
MW:     432.267920 g/mol MF: C19H18BrN3O4
IUPAC name: (5Z)-5-(3-bromo-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)...
Create Date: 2006-10-26
CID: 11407808

3572. CCT018159 analog 12; CHEMBL365700; BDBM15373 ...
MW:     401.843500 g/mol MF: C20H20ClN3O4
IUPAC name: (5Z)-5-(3-chloro-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene...
Create Date: 2006-10-26
CID: 11406962

3573. A313326 Analogue 50; CHEMBL156387; BDBM13406 ...
MW:     456.898723 g/mol MF: C26H18ClFN4O
IUPAC name: 3-(3-chlorophenyl)-4-[[(4-cyano-2-fluorophenyl)-(3-methylimi...
Create Date: 2006-10-26
CID: 11396942

3574. A313326 Analogue 23; CHEMBL156523; BDBM13387 ...
MW:     484.453626 g/mol MF: C27H18F2N4O3
IUPAC name: 4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-3...
Create Date: 2006-10-26
CID: 11375135

3575. A313326 Analogue 51; CHEMBL155785; BDBM13407 ...
MW:     481.896770 g/mol MF: C26H19ClF3N3O
IUPAC name: 3-(3-chlorophenyl)-4-[[(3-methylimidazol-4-yl)-[4-(trifluoro...
Create Date: 2006-10-26
CID: 11375079

3576. A313326 Analogue 33; CHEMBL345895; BDBM13396 ...
MW:     454.477280 g/mol MF: C26H22N4O4
IUPAC name: 4-[[2-(3-methoxyphenyl)-4-nitrophenyl]methoxy-(3-methylimida...
Create Date: 2006-10-26
CID: 11374441

3577. A313326 Analogue 27; CHEMBL155876; BDBM13392 ...
MW:     448.515760 g/mol MF: C28H24N4O2
IUPAC name: 4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-3...
Create Date: 2006-10-26
CID: 11362876

3578. CHEMBL127296; A313326 Analogue 15; BDBM13379 ...
MW:     404.463200 g/mol MF: C26H20N4O
IUPAC name: 4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-3...
Create Date: 2006-10-26
CID: 11361710

3579. A313326 Analogue 35; CHEMBL155939; BDBM13398 ...
MW:     502.584740 g/mol MF: C27H26N4O4S
IUPAC name: N-[4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl...
Create Date: 2006-10-26
CID: 11352596

3580. Capped Tripeptide Analog 16; CHEMBL3349026; BDBM13180 ...
MW:     442.594220 g/mol MF: C25H38N4O3
IUPAC name: (2S)-1-[(2S)-3,3-dimethyl-2-[[(2R)-2-(methylamino)propanoyl]...
Create Date: 2006-10-26
CID: 11351234

3581. A313326 Analogue 16; CHEMBL160670; BDBM13380 ...
MW:     454.521880 g/mol MF: C30H22N4O
IUPAC name: 4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-3...
Create Date: 2006-10-26
CID: 11340002

3582. A313326 Analogue 45; CHEMBL347174; BDBM13402 ...
MW:     437.489820 g/mol MF: C27H23N3O3
IUPAC name: 4-[[4-formyl-2-(3-methoxyphenyl)phenyl]methoxy-(3-methylimid...
Create Date: 2006-10-26
CID: 11339578

3583. A313326 Analogue 36; CHEMBL157692; BDBM13399 ...
MW:     496.557020 g/mol MF: C29H28N4O4
IUPAC name: N-[4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl...
Create Date: 2006-10-26
CID: 11329445

3584. Capped Tripeptide Analog 15; CHEMBL2371814; BDBM13179 ...
MW:     482.658080 g/mol MF: C28H42N4O3
IUPAC name: (2S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(dimethylamino)propanoy...
Create Date: 2006-10-26
CID: 11329163

3585. A313326 Analogue 21; CHEMBL2114434; BDBM13385 ...
MW:     434.489180 g/mol MF: C27H22N4O2
IUPAC name: 4-[[(S)-(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methy...
Create Date: 2006-10-26
CID: 11327980

3586. A313326 Analogue 34; CHEMBL346696; BDBM13397 ...
MW:     424.494360 g/mol MF: C26H24N4O2
IUPAC name: 4-[[4-amino-2-(3-methoxyphenyl)phenyl]methoxy-(3-methylimida...
Create Date: 2006-10-26
CID: 11327727

3587. A313326 Analogue 20; CHEMBL399482; BDBM13384 ...
MW:     434.489180 g/mol MF: C27H22N4O2
IUPAC name: 4-[[(R)-(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methy...
Create Date: 2006-10-26
CID: 11305084

3588. Capped Tripeptide Analog 13; CHEMBL2371816; BDBM13177 ...
MW:     456.620800 g/mol MF: C26H40N4O3
IUPAC name: (2S)-1-[(2S)-2-[[(2S)-2-(dimethylamino)propanoyl]amino]-3,3-...
Create Date: 2006-10-26
CID: 11282499

3589. A313326 Analogue 55; CHEMBL156026; BDBM13411 ...
MW:     479.913820 g/mol MF: C28H18ClN3O3
IUPAC name: 3-(1,3-benzodioxol-5-yl)-4-[[(4-chloropyridin-3-yl)-(4-cyano...
Create Date: 2006-10-26
CID: 11271575

3590. A313326 Analogue 26; CHEMBL160562; BDBM13391 ...
MW:     434.489180 g/mol MF: C27H22N4O2
IUPAC name: 4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-3...
Create Date: 2006-10-26
CID: 11247532

3591. A313326 Analogue 60c; CHEMBL158333; BDBM13414 ...
MW:     533.600320 g/mol MF: C30H23N5O3S
IUPAC name: N-[5-cyano-2-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methox...
Create Date: 2006-10-26
CID: 11237934

3592. A313326 Analogue 30; CHEMBL206288; BDBM13395 ...
MW:     440.444126 g/mol MF: C26H18F2N4O
IUPAC name: 4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-3...
Create Date: 2006-10-26
CID: 11224449

3593. A313326 Analogue 54; CHEMBL347482; BDBM13410 ...
MW:     441.932040 g/mol MF: C25H16ClN3OS
IUPAC name: 3-(3-chlorophenyl)-4-[[(4-cyanophenyl)-(1,3-thiazol-5-yl)met...
Create Date: 2006-10-26
CID: 11212886

3594. A313326 Analogue 47; CHEMBL347172; BDBM13403 ...
MW:     443.924780 g/mol MF: C26H22ClN3O2
IUPAC name: 4-[[(4-chlorophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-...
Create Date: 2006-10-26
CID: 11189976

3595. A313326 Analogue 53; CHEMBL346290; BDBM13409 ...
MW:     462.499280 g/mol MF: C28H22N4O3
IUPAC name: 3-(1,3-benzodioxol-5-yl)-4-[[(4-cyanophenyl)-(2,3-dimethylim...
Create Date: 2006-10-26
CID: 11178719

3596. A313326 Analogue 62; CHEMBL160193; BDBM13416 ...
MW:     447.487940 g/mol MF: C27H21N5O2
IUPAC name: N-[5-cyano-2-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methox...
Create Date: 2006-10-26
CID: 11166764

3597. chlamydocin-aldehyde analog, 7; BDBM19161; 6-[(3S,9S,14aR)-9-benzyl-6,6-dimethyl-1,4,7,10-tetraoxo-tetradecahydropyrrolo[1,2-a][,,,]cyclododecan-3-yl]hexanal
MW:     484.587840 g/mol MF: C26H36N4O5
IUPAC name: 6-[(3S,9S,12R)-3-benzyl-6,6-dimethyl-2,5,8,11-tetraoxo-1,4,7...
Create Date: 2006-10-26
CID: 10896194

3598. CGS 27023A Analog 4; CHEMBL82203; SCHEMBL7343386 ...
MW:     320.792380 g/mol MF: C12H17ClN2O4S
IUPAC name: 2-[(4-chlorophenyl)sulfonyl-(2-methylpropyl)amino]-N-hydroxy...
Create Date: 2006-10-26
CID: 10853176

3599. CGS 27023A Analog 6; CHEMBL310520; SCHEMBL7347286 ...
MW:     300.373900 g/mol MF: C13H20N2O4S
IUPAC name: N-hydroxy-2-[(4-methylphenyl)sulfonyl-(2-methylpropyl)amino]...
Create Date: 2006-10-26
CID: 10732988

3600. CGS 27023A Analog 9; CHEMBL316232; SCHEMBL7349859 ...
MW:     301.361960 g/mol MF: C12H19N3O4S
IUPAC name: 2-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-N-hydroxya...
Create Date: 2006-10-25
CID: 10709434

3601. CGS 27023A Analog 8; CHEMBL310559; SCHEMBL7343818 ...
MW:     329.415120 g/mol MF: C14H23N3O4S
IUPAC name: 2-[[4-(dimethylamino)phenyl]sulfonyl-(2-methylpropyl)amino]-...
Create Date: 2006-10-25
CID: 10640100

3602. CHEMBL75274; Tacrine-Based Inhibitor 2g; Tacrine Dimer 3c ...
MW:     506.724080 g/mol MF: C34H42N4
IUPAC name: N,N'-bis(1,2,3,4-tetrahydroacridin-9-yl)octane-1,8-diamine
Create Date: 2006-10-25
CID: 10625415

3603. CGS 27023A Analog 5; CHEMBL310422; SCHEMBL7351771 ...
MW:     286.347320 g/mol MF: C12H18N2O4S
IUPAC name: 2-[benzenesulfonyl(2-methylpropyl)amino]-N-hydroxyacetamide
Create Date: 2006-10-25
CID: 10613211

3604. Rapamycin C-7, analog 10b; BDBM36620
MW:     950.203960 g/mol MF: C54H79NO13
Create Date: 2006-10-25
CID: 10486039

3605. Rapamycin C-7, analog 11b; BDBM36622
MW:     949.219200 g/mol MF: C54H80N2O12
Create Date: 2006-10-25
CID: 10396108

3606. Ciprofloxacin Homodimer Analog; CHEMBL296393; 7,7'-[1,4-Phenylenebis(methylenepiperazine-1,4-diyl)]bis(1-cyclopropyl-4-oxo-6-fluoro-1,4-dihydroquinoline-3-carboxylic acid) ...
MW:     764.816286 g/mol MF: C42H42F2N6O6
IUPAC name: 7-[4-[[4-[[4-(3-carboxy-1-cyclopropyl-6-fluoro-4-oxoquinolin...
Create Date: 2006-10-25
CID: 10327813

3607. spiropiperidine analogue, 50; CHEMBL473904; BDBM26929 ...
MW:     487.464480 g/mol MF: C26H32Cl2N4O
IUPAC name: 8-[(2,6-dichlorophenyl)methyl]-1-phenyl-3-(2-pyrrolidin-1-yl...
Create Date: 2006-10-25
CID: 10323169

3608. pyrrolidine urea analogue, 10; CHEMBL381086; SCHEMBL1349678 ...
MW:     396.229246 g/mol MF: C17H16BrF2N3O
IUPAC name: 1-(2-bromophenyl)-3-[(3R)-1-(3,4-difluorophenyl)pyrrolidin-3...
Create Date: 2006-10-25
CID: 10294155

3609. pyrrolidine urea analogue, 7; CHEMBL207542; SCHEMBL1349586 ...
MW:     374.274900 g/mol MF: C18H20BrN3O
IUPAC name: 1-(2-bromophenyl)-3-[(3S)-1-(3-methylphenyl)pyrrolidin-3-yl]...
Create Date: 2006-10-25
CID: 10292768

3610. P3 pyridyl oxazole analog 7; BDBM9149; SCHEMBL5254169 ...
MW:     750.806410 g/mol MF: C39H45F3N6O6
IUPAC name: (2S)-1-[(2S,4R)-4-benzyl-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4...
Create Date: 2006-10-25
CID: 10283896

3611. A313326 Analogue 64; CHEMBL352237; SCHEMBL2226657 ...
MW:     447.487940 g/mol MF: C27H21N5O2
IUPAC name: 5-cyano-2-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]m...
Create Date: 2006-10-25
CID: 10253040

3612. spiropiperidine analogue, 14; CHEMBL472676; BDBM26893 ...
MW:     439.591820 g/mol MF: C29H33N3O
IUPAC name: 8-benzhydryl-1-phenyl-3-propan-2-yl-1,3,8-triazaspiro[4.5]de...
Create Date: 2006-10-25
CID: 10252647

3613. CHEMBL43455; A313326 Analogue 19; SCHEMBL5099753 ...
MW:     434.489180 g/mol MF: C27H22N4O2
IUPAC name: 4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-3...
Create Date: 2006-10-25
CID: 10238214

3614. A313326 Analogue 11; CHEMBL157077; SCHEMBL5089146 ...
MW:     457.951360 g/mol MF: C27H24ClN3O2
IUPAC name: 4-[[4-chloro-2-(3-ethoxyphenyl)phenyl]methoxy-(3-methylimida...
Create Date: 2006-10-25
CID: 10226337

3615. Triazolopiperazine Analogue 28; SCHEMBL2667451; BDBM11164 ...
MW:     403.349736 g/mol MF: C17H18F5N5O
IUPAC name: (3R)-3-amino-4-(2,5-difluorophenyl)-1-[3-(2,2,2-trifluoroeth...
Create Date: 2006-10-25
CID: 10222794

3616. pyrrolidine urea analogue, 11; CHEMBL210803; SCHEMBL1351419 ...
MW:     392.265363 g/mol MF: C18H19BrFN3O
IUPAC name: 1-(2-bromophenyl)-3-[(3R)-1-(3-fluoro-4-methylphenyl)pyrroli...
Create Date: 2006-10-25
CID: 10222094

3617. CHEMBL194482; phenanthridinone analogue, 14; SCHEMBL6407850 ...
MW:     394.508140 g/mol MF: C27H26N2O
IUPAC name: 2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-5H-phenan...
Create Date: 2006-10-25
CID: 10216071

3618. pyrrolidine urea analogue, 8; CHEMBL207617; SCHEMBL1351293 ...
MW:     374.274900 g/mol MF: C18H20BrN3O
IUPAC name: 1-(2-bromophenyl)-3-[(3R)-1-(3-methylphenyl)pyrrolidin-3-yl]...
Create Date: 2006-10-25
CID: 10199387

3619. A313326 Analogue 24; CHEMBL435247; SCHEMBL5094183 ...
MW:     448.515760 g/mol MF: C28H24N4O2
IUPAC name: 4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-3...
Create Date: 2006-10-25
CID: 10195107

3620. pyrrolidine urea analogue, 9; CHEMBL207618; SCHEMBL1349271 ...
MW:     378.238783 g/mol MF: C17H17BrFN3O
IUPAC name: 1-(2-bromophenyl)-3-[(3R)-1-(3-fluorophenyl)pyrrolidin-3-yl]...
Create Date: 2006-10-25
CID: 10177660

3621. A313326 Analogue 60b; CHEMBL347435; SCHEMBL5089122 ...
MW:     497.568220 g/mol MF: C27H23N5O3S
IUPAC name: N-[5-cyano-2-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methox...
Create Date: 2006-10-25
CID: 10163807

3622. spiropiperidine analogue, 10; CHEMBL510201; BDBM26889 ...
MW:     411.538660 g/mol MF: C27H29N3O
IUPAC name: 8-benzhydryl-3-methyl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4...
Create Date: 2006-10-25
CID: 10158555

3623. A313326 Analogue 22; CHEMBL158139; SCHEMBL5089090 ...
MW:     448.472700 g/mol MF: C27H20N4O3
IUPAC name: 3-(1,3-benzodioxol-5-yl)-4-[[(4-cyanophenyl)-(3-methylimidaz...
Create Date: 2006-10-25
CID: 10138658

3624. A313326 Analogue 10; CHEMBL157794; SCHEMBL5092989 ...
MW:     443.924780 g/mol MF: C26H22ClN3O2
IUPAC name: 4-[[4-chloro-2-(3-methoxyphenyl)phenyl]methoxy-(3-methylimid...
Create Date: 2006-10-25
CID: 10138363

3625. CHEMBL158553; A313326 Analogue 18; SCHEMBL5088991 ...
MW:     438.908260 g/mol MF: C26H19ClN4O
IUPAC name: 3-(3-chlorophenyl)-4-[[(4-cyanophenyl)-(3-methylimidazol-4-y...
Create Date: 2006-10-25
CID: 10127337

3626. Rapamycin C-7, analog 10a; BDBM36619
MW:     950.203960 g/mol MF: C54H79NO13
Create Date: 2006-10-25
CID: 10079556

3627. Rapamycin C-7, analog 11a; BDBM36621
MW:     949.219200 g/mol MF: C54H80N2O12
Create Date: 2006-10-25
CID: 10056711

3628. spiropiperidine analogue, 37; CHEMBL457451; BDBM26916 ...
MW:     563.560440 g/mol MF: C32H36Cl2N4O
IUPAC name: 8-[bis(2-chlorophenyl)methyl]-1-phenyl-3-(2-pyrrolidin-1-yle...
Create Date: 2006-10-25
CID: 9937777

3629. Homodimeric Tacrine Analog 3h; BDBM9054; CHEMBL307004 ...
MW:     561.587620 g/mol MF: C33H38Cl2N4
IUPAC name: N,N'-bis(6-chloro-1,2,3,4-tetrahydroacridin-9-yl)heptane-1,7...
Create Date: 2006-10-25
CID: 9894056

3630. A313326 Analogue 65; CHEMBL155310; SCHEMBL5099614 ...
MW:     481.933000 g/mol MF: C27H20ClN5O2
IUPAC name: N-(3-chlorophenyl)-5-cyano-2-[[(4-cyanophenyl)-(3-methylimid...
Create Date: 2006-10-25
CID: 9869839

3631. Homodimeric Tacrine Analog 3i; BDBM9055; CHEMBL312310 ...
MW:     575.614200 g/mol MF: C34H40Cl2N4
IUPAC name: N,N'-bis(6-chloro-1,2,3,4-tetrahydroacridin-9-yl)octane-1,8-...
Create Date: 2006-10-25
CID: 9851127

3632. Homodimeric Tacrine Analog 3f; BDBM9052; CHEMBL312761 ...
MW:     542.705006 g/mol MF: C34H40F2N4
IUPAC name: N,N'-bis(6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)octane-1,8-...
Create Date: 2006-10-25
CID: 9850331

3633. A313326 Analogue 60a; CHEMBL156107; SCHEMBL5091222 ...
MW:     489.569360 g/mol MF: C24H19N5O3S2
IUPAC name: N-[5-cyano-2-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methox...
Create Date: 2006-10-25
CID: 9848392

3634. CHEMBL439753; Isatin Sulfonamide 34; JMC522188 Compound 2 ...
MW:     476.544160 g/mol MF: C26H24N2O5S
IUPAC name: 1-benzyl-5-[(2S)-2-(phenoxymethyl)pyrrolidin-1-yl]sulfonylin...
Create Date: 2006-10-25
CID: 9847835

3635. CHEMBL74927; Homodimeric Tacrine Analog 3e; BDBM9051 ...
MW:     528.678426 g/mol MF: C33H38F2N4
IUPAC name: N,N'-bis(6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)heptane-1,7...
Create Date: 2006-10-25
CID: 9828345

3636. spiropiperidine analogue, 26; CHEMBL473068; BDBM26905 ...
MW:     523.496580 g/mol MF: C29H32Cl2N4O
IUPAC name: 8-[bis(2-chlorophenyl)methyl]-3-[2-(methylamino)ethyl]-1-phe...
Create Date: 2006-10-25
CID: 9806799

3637. bis(7)-Tacrine; CHEMBL32823; Tacrine-Based Inhibitor 2f ...
MW:     492.697500 g/mol MF: C33H40N4
IUPAC name: N,N'-bis(1,2,3,4-tetrahydroacridin-9-yl)heptane-1,7-diamine
Create Date: 2006-10-13
CID: 9549196

3638. 4-BROMO-3-(CARBOXYMETHOXY)THIOPHENE-2-CARBOXYLIC ACID; 2hb1; Monocyclic thiophene analog 2 ...
MW:     281.080600 g/mol MF: C7H5BrO5S
IUPAC name: 4-bromo-3-(carboxymethoxy)thiophene-2-carboxylic acid
Create Date: 2006-09-12
CID: 9547975

3639. C1A; imidothiocarbamate analogue, 1; CHEMBL213969 ...
MW:     366.508080 g/mol MF: C14H22N8S2
IUPAC name: [4-[[N-(diaminomethylidene)carbamimidoyl]sulfanylmethyl]-2,5...
Create Date: 2006-08-16
CID: 9543473

3640. AC1OCFUH; Capped Tripeptide Analog 11; CHEMBL2371815 ...
MW:     468.631500 g/mol MF: C27H40N4O3
IUPAC name: (2S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]...
Create Date: 2006-07-28
CID: 6918762

3641. AC1O5SCD; AC1Q33ZO; CHEMBL20501 ...
MW:     338.483100 g/mol MF: C23H30O2
IUPAC name: ethyl 4-[(1E,3E)-2-methyl-4-(2,6,6-trimethylcyclohexen-1-yl)...
Create Date: 2006-04-28
CID: 6439754

3642. N,N-dimethyl-4-(4-phenyl-1H-pyrazol-3-yl)-1H-pyrrole-2-carboxamide; Oprea1_828620; Pyrrole Carboxamide Analog 1 ...
MW:     280.324440 g/mol MF: C16H16N4O
IUPAC name: (4Z)-N,N-dimethyl-4-(4-phenyl-1,2-dihydropyrazol-3-ylidene)p...
Create Date: 2006-03-21
CID: 6096886

3643. 2,4(1H,3H)-Pyrimidinedione, 1-(3-azido-2,3,4-trideoxy-b-threo-hexopyranosyl)-5-methyl-; 129779-69-7; AC1NUHWE ...
MW:     281.267900 g/mol MF: C11H15N5O4
IUPAC name: 1-[(2R,4S,6S)-4-azido-6-(hydroxymethyl)oxan-2-yl]-5-methylpy...
Create Date: 2005-08-01
CID: 5479187

3644. N-METHYLALANYL-3-METHYLVALYL-4-PHENOXY-N-(1,2,3,4-TETRAHYDRONAPHTHALEN-1-YL)PROLINAMIDE; (2S,4S)-1-[(2S)-3,3-dimethyl-2-[(2S)-2-(methylamino)propanamido]butanoyl]-4-phenoxy-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrrolidine-2-carboxamide; 1-[3,3-DIMETHYL-2-(2-METHYLAMINO-PROPIONYLAMINO)-BUTYRYL]-4-PHENOXY-PYRROLIDINE-2-CARBOXYLIC ACID(1,2,3,4-TETRAHYDRO-NAPHTHALEN-1-YL)-AMIDE ...
MW:     534.689580 g/mol MF: C31H42N4O4
IUPAC name: (2S,4S)-1-[(2S)-3,3-dimethyl-2-[[(2S)-2-(methylamino)propano...
Create Date: 2005-06-24
CID: 5388929

3645. 14816-17-2; AC1NSEL7; PHOXIM OXYGEN ANALOGUE ...
MW:     282.232262 g/mol MF: C12H15N2O4P
IUPAC name: [(E)-[cyano(phenyl)methylidene]amino] diethyl phosphate
Create Date: 2005-03-26
CID: 5360459

3646. CHEMBL57323; 6-arylpyrido[2,3-d]pyrimidine deriv. 15; AC1NS3TB ...
MW:     364.444160 g/mol MF: C20H24N6O
IUPAC name: 1-[2-amino-6-(2,6-dimethylphenyl)pyrido[2,3-d]pyrimidin-7-yl...
Create Date: 2006-01-30
CID: 5328117

3647. AC1NS3IE; Modified Benzophenone Carbonyl, Balanol Analog 26; BDBM3226 ...
MW:     534.514040 g/mol MF: C28H26N2O9
IUPAC name: [(3R,4R)-3-[(4-hydroxybenzoyl)amino]azepan-4-yl] 3,5-dihydro...
Create Date: 2006-01-30
CID: 5327985

3648. AC1NS3IB; Modified Benzophenone Carbonyl, Balanol Analog 25; BDBM3225 ...
MW:     536.529920 g/mol MF: C28H28N2O9
IUPAC name: 2-[[2,6-dihydroxy-4-[(3R,4R)-3-[(4-hydroxybenzoyl)amino]azep...
Create Date: 2006-01-30
CID: 5327984

3649. AC1NS3I8; Modified Benzophenone Carbonyl, Balanol Analog 24; BDBM3224 ...
MW:     462.451380 g/mol MF: C25H22N2O7
IUPAC name: 3-hydroxy-2-[4-[(3R,4R)-4-[(4-hydroxybenzoyl)amino]pyrrolidi...
Create Date: 2006-01-30
CID: 5327983

3650. AC1NS3I5; Modified Benzophenone Carbonyl, Balanol Analog 23; BDBM3223 ...
MW:     478.450780 g/mol MF: C25H22N2O8
IUPAC name: 2-[2,6-dihydroxy-4-[(3R,4R)-4-[(4-hydroxybenzoyl)amino]pyrro...
Create Date: 2006-01-30
CID: 5327982

3651. AC1NS3I2; Modified Benzophenone Carbonyl, Balanol Analog 22; BDBM3222 ...
MW:     535.502100 g/mol MF: C27H25N3O9
IUPAC name: 2-(N-[2,6-dihydroxy-4-[(3R,4R)-4-[(4-hydroxybenzoyl)amino]py...
Create Date: 2006-01-30
CID: 5327981

3652. AC1NS3HZ; Modified Benzophenone Carbonyl, Balanol Analog 21; BDBM3221 ...
MW:     521.475520 g/mol MF: C26H23N3O9
IUPAC name: 2-[[2,6-dihydroxy-4-[(3R,4R)-4-[(4-hydroxybenzoyl)amino]pyrr...
Create Date: 2006-01-30
CID: 5327980

3653. AC1NS2QX; CHEMBL8971; 1,5-Diphenyl-3-methylpyrazole (DPP) analogue 29 ...
MW:     292.374900 g/mol MF: C19H20N2O
IUPAC name: 2-(4-ethyl-1,5-diphenylpyrazol-3-yl)ethanol
Create Date: 2006-01-30
CID: 5327639

3654. AC1NS2QU; 1,5-Diphenyl-3-methylpyrazole (DPP) analogue 22; BDBM2313 ...
MW:     272.343740 g/mol MF: C19H16N2
IUPAC name: 3-methyl-1,5-diphenyl-4-prop-2-ynylpyrazole
Create Date: 2006-01-30
CID: 5327638

3655. AC1NS2QR; 1,5-Diphenyl-3-methylpyrazole (DPP) analogue 11; BDBM2312 ...
MW:     262.348920 g/mol MF: C18H18N2
IUPAC name: 4-ethyl-3-methyl-1,5-diphenylpyrazole
Create Date: 2006-01-30
CID: 5327637

3656. UN3; 1-METHYL-3-PHENYL-1H-PYRAZOL-5-YLSULFAMIC ACID; (2-METHYL-5-PHENYL-2H-PYRAZOL-3-YL)-SULFAMIC ACID ...
MW:     253.277640 g/mol MF: C10H11N3O3S
IUPAC name: (2-methyl-5-phenylpyrazol-3-yl)sulfamic acid
Create Date: 2006-01-26
CID: 5327154

3657. (5-CHLOROPYRAZOLO[1,5-A]PYRIMIDIN-7-YL)-(4-METHANESULFONYLPHENYL)AMINE; Pyrazolo[1,5-a]pyrimidin-7-amine, 5-chloro-N-[4-(methylsulfonyl)phenyl]-; 771498-73-8 ...
MW:     322.770040 g/mol MF: C13H11ClN4O2S
IUPAC name: 5-chloro-N-(4-methylsulfonylphenyl)pyrazolo[1,5-a]pyrimidin-...
Create Date: 2005-11-29
CID: 5287989

3658. UNII-09RR39UU4V; CHEBI:34550; AC1NQZWA ...
MW:     490.638700 g/mol MF: C23H30N4O4S2
IUPAC name: N-[5-[(5-tert-butyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thia...
Create Date: 2005-10-11
CID: 5282335

3659. Sitagliptin; 486460-32-6; Januvia ...
MW:     407.313619 g/mol MF: C16H15F6N5O
IUPAC name: (3R)-3-amino-1-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]tr...
Create Date: 2005-06-24
CID: 4369359

3660. BAS 05215391; AC1MK6TI; TimTec1_008036 ...
MW:     338.274400 g/mol MF: C16H10N4O5
IUPAC name: 6-[(2,3-dioxo-1,4-dihydroquinoxalin-6-yl)oxy]-1,4-dihydroqui...
Create Date: 2005-08-09
CID: 3151867

3661. BRN 2758880; N-(p-(Trifluoromethylthio)phenyl)anthranilic acid; Anthranilic acid, N-(p-(trifluoromethylthio)phenyl)- ...
MW:     313.294910 g/mol MF: C14H10F3NO2S
IUPAC name: 2-[4-(trifluoromethylsulfanyl)anilino]benzoic acid
Create Date: 2005-08-09
CID: 3040098

3662. 181305-25-9; Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-(2,6-difluoro-3-(methoxymethyl)phenyl)ethyl)-; 1-(5-bromopyridin-2-yl)-3-[2-[2,6-difluoro-3-(methoxymethyl)phenyl]ethyl]thiourea ...
MW:     416.283546 g/mol MF: C16H16BrF2N3OS
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-[2,6-difluoro-3-(methoxymethyl)...
Create Date: 2005-08-01
CID: 3001151

3663. 181305-23-7; 1-(5-bromopyridin-2-yl)-3-[2-(3-ethoxy-2,6-difluorophenyl)ethyl]thiourea; Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-(3-ethoxy-2,6-difluorophenyl)ethyl)- ...
MW:     416.283546 g/mol MF: C16H16BrF2N3OS
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-(3-ethoxy-2,6-difluorophenyl)et...
Create Date: 2005-08-01
CID: 3001150

3664. PT-115; 149488-76-6; 1-(5-bromopyridin-2-yl)-3-[2-(2,6-difluoro-3-methoxyphenyl)ethyl]thiourea ...
MW:     402.256966 g/mol MF: C15H14BrF2N3OS
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-(2,6-difluoro-3-methoxyphenyl)e...
Create Date: 2005-08-01
CID: 3001149

3665. 181305-22-6; Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-(3-(dimethylamino)-2,6-difluorophenyl)ethyl)-; 1-(5-bromopyridin-2-yl)-3-[2-[3-(dimethylamino)-2,6-difluorophenyl]ethyl]thiourea ...
MW:     415.298786 g/mol MF: C16H17BrF2N4S
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-[3-(dimethylamino)-2,6-difluoro...
Create Date: 2005-08-01
CID: 3001148

3666. PT-110; 181305-20-4; 1-(5-chloropyridin-2-yl)-3-[2-(3-cyano-2,6-difluorophenyl)ethyl]thiourea ...
MW:     352.789446 g/mol MF: C15H11ClF2N4S
IUPAC name: 1-(5-chloropyridin-2-yl)-3-[2-(3-cyano-2,6-difluorophenyl)et...
Create Date: 2005-08-01
CID: 3001147

3667. 149488-24-4; Acetamide, N-((3-(2-((((5-bromo-2-pyridinyl)amino)thioxomethyl)amino)ethyl)-2,4-difluorophenyl)methyl)-; N-(2-(2,6-Difluoro-3-(acetamidomethyl)phenethyl))-N'-(2-(5-bromopyridyl))thiourea ...
MW:     443.308886 g/mol MF: C17H17BrF2N4OS
IUPAC name: N-[[3-[2-[(5-bromopyridin-2-yl)carbamothioylamino]ethyl]-2,4...
Create Date: 2005-08-01
CID: 3001146

3668. 181305-21-5; Thiourea, N-(5-chloro-2-pyridinyl)-N'-(2-(3-(dimethylamino)-2,6-difluorophenyl)ethyl)-; 1-(5-chloropyridin-2-yl)-3-[2-[3-(dimethylamino)-2,6-difluorophenyl]ethyl]thiourea ...
MW:     370.847786 g/mol MF: C16H17ClF2N4S
IUPAC name: 1-(5-chloropyridin-2-yl)-3-[2-[3-(dimethylamino)-2,6-difluor...
Create Date: 2005-08-01
CID: 3001080

3669. PT-113; AC1MHDJY; LY300046HCl Analog 2 ...
MW:     429.282306 g/mol MF: C16H15BrF2N4OS
IUPAC name: 3-[2-[(5-bromopyridin-2-yl)carbamothioylamino]ethyl]-2,4-dif...
Create Date: 2005-08-01
CID: 3001079

3670. PSTQ Analog, 3{1,3}; AC1M23R0; SCHEMBL8031022 ...
MW:     367.424880 g/mol MF: C18H17N5O2S
IUPAC name: 3-(benzenesulfonyl)-N-propan-2-yltriazolo[1,5-a]quinazolin-5...
Create Date: 2005-07-14
CID: 2136382

3671. CHEMBL73800; Bis-THA inhibitor 5; AC1LUYBX ...
MW:     478.670920 g/mol MF: C32H38N4
IUPAC name: N,N'-bis(1,2,3,4-tetrahydroacridin-9-yl)hexane-1,6-diamine
Create Date: 2005-07-11
CID: 1593398

3672. AC1LDIWN; 3-Fluorofentanyl acetyl analog; ALHJAWKAFTYWPM-UHFFFAOYSA-N ...
MW:     340.434403 g/mol MF: C21H25FN2O
IUPAC name: N-(3-fluorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]acetam...
Create Date: 2005-03-27
CID: 619325

3673. AC1LDIWK; 2-Fluorofentanyl acetyl analog; BYNZSMMSBDZPJJ-UHFFFAOYSA-N ...
MW:     340.434403 g/mol MF: C21H25FN2O
IUPAC name: N-(2-fluorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]acetam...
Create Date: 2005-03-27
CID: 619324

3674. tolfenamic acid; 13710-19-5; Clotam ...
MW:     261.703580 g/mol MF: C14H12ClNO2
IUPAC name: 2-(3-chloro-2-methylanilino)benzoic acid
Create Date: 2005-03-27
CID: 610479

3675. AC1LARPJ; CHEMBL72044; sialic acid aromatic analog 3 ...
MW:     326.305220 g/mol MF: C13H18N4O6
IUPAC name: 4-acetamido-3-(diaminomethylideneamino)-5-[(1S,2R)-1,2,3-tri...
Create Date: 2005-08-01
CID: 493851

3676. 6-[[(2-methoxynaphthalen-1-yl)amino]methyl]-5-methylpyrido[2,3-d]pyrimidine-2,4-diamine; 6-{[(2-methoxynaphthalen-1-yl)amino]methyl}-5-methylpyrido[2,3-d]pyrimidine-2,4-diamine; AC1L9TNY ...
MW:     360.412400 g/mol MF: C20H20N6O
IUPAC name: 6-[[(2-methoxynaphthalen-1-yl)amino]methyl]-5-methylpyrido[2...
Create Date: 2005-08-01
CID: 475794

3677. N'-[2-[[2-[(pyridine-4-carbonylamino)carbamoyl]phenyl]disulfanyl]benzoyl]pyridine-4-carbohydrazide; AC1LABLA; 2,2-Dithiobisbenzamide analog ...
MW:     544.604800 g/mol MF: C26H20N6O4S2
IUPAC name: N'-[2-[[2-[(pyridine-4-carbonylamino)carbamoyl]phenyl]disulf...
Create Date: 2005-08-01
CID: 465374

3678. 162540-61-6; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-11-oxo-3-(phenylmethyl)-9-((4-(2-(3-pyridinyloxy)ethoxy)phenyl)methyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-11-oxo-3-(phenylmethyl)-9-[[4-[2-(3-pyridinyloxy)ethoxy]phenyl]methyl]-, 1,1-dimethylethyl ester, [3S-(3R*,4S*,8S*,9R*)]- ...
MW:     680.830780 g/mol MF: C37H52N4O8
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-3-[(2-...
Create Date: 2005-08-01
CID: 463279

3679. 162539-57-3; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-11-oxo-3-(phenylmethyl)-9-((4-(2-(2-pyridinyl)ethoxy)phenyl)methyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-; [1S-[1R*,2S*(2S*,3R*)]]-[3-[[3-[[(1,1-Dimethylethoxy)-carbonyl]amino]-2-hydroxy-4-(4-[2-(2-pyridinyl)ethoxy]phenyl]butyl]amino]-2-hydroxy-1-(phenylmethyl)propyl]carbamic Acid, 1,1-Dimethylethyl Ester ...
MW:     664.831380 g/mol MF: C37H52N4O7
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-3-[(2-...
Create Date: 2005-08-01
CID: 463278

3680. 162540-49-0; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-3-((4-(2-(1H-imidazol-1-yl)ethoxy)phenyl)methyl)-13,13-dimethyl-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-3-[[4-[2-(1H-imidazol-1-yl)ethoxy]phenyl]methyl]-13,13-dimethyl-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, [3S-(3R*,4S*,8S*,9R*)]- ...
MW:     653.808740 g/mol MF: C35H51N5O7
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-4-[4-(...
Create Date: 2005-08-01
CID: 463277

3681. 162540-97-8; [1S-[1R*,2S*(2S*,3R*)]]-[3-[[3-[[(1,1-Dimethylethoxy)-carbonyl]amino]-2-hydroxy-4-(2-hydroxyphenyl)butyl]amino]-2-hydroxy-1-(phenylmethyl)propyl]carbamic Acid, 1,1-Dimethylethyl ester; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-3-((2-hydroxyphenyl)methyl)-13,13-dimethyl-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))- ...
MW:     559.694200 g/mol MF: C30H45N3O7
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-4-(2-h...
Create Date: 2005-08-01
CID: 463276

3682. Tyr Aminodiol isostere; 162538-24-1; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-3-((3-hydroxyphenyl)methyl)-13,13-dimethyl-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))- ...
MW:     559.694200 g/mol MF: C30H45N3O7
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-4-(3-h...
Create Date: 2005-08-01
CID: 463275

3683. [1S-[1R*,2S*(2S*,3R*)]]-[3-[[3-[[(1,1-Dimethylethoxy)-carbonyl]amino]-2-hydroxy-4-phenylbutyl]amino]-2-hydroxy-1-(6-quinolinylmethyl)propyl]carbamic Acid, 1,1-Dimethylethyl ester; 175233-59-7; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-11-oxo-3-(phenylmethyl)-9-(2-quinolinylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-(1S-(1R*,2S*(2S*,3R*)))-(3-((3-(((1,1-Dimethylethoxy)-carbonyl)amino)-2-hydroxy-4-phenylbutyl)amino)-2-hydroxy-1-(6-quinolinylmethyl)propyl)carbamic Acid, 1,1-Dimethylethyl ester ...
MW:     594.741540 g/mol MF: C33H46N4O6
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-3-[(2-...
Create Date: 2005-08-01
CID: 463274

3684. 162538-25-2; [1S-[1R*,2S*(2S*,3R*)]]-[3-[[3-[[(1,1-Dimethylethoxy)-carbonyl]amino]-2-hydroxy-4-phenylbutyl]amino]-2-hydroxy-1-(4-pyridinylmethyl)propyl]carbamic Acid, 1,1-Dimethylethyl ester; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-11-oxo-3-(phenylmethyl)-9-(4-pyridinylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))- ...
MW:     544.682860 g/mol MF: C29H44N4O6
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-3-[(2-...
Create Date: 2005-08-01
CID: 463273

3685. 2-(3a,7a-dihydro-1,3-benzothiazol-2-yldisulfanyl)-3a,7a-dihydro-1,3-benzothiazole; AC1LA77E; Benzothiazole disulfide analog ...
MW:     336.518480 g/mol MF: C14H12N2S4
IUPAC name: 2-(3a,7a-dihydro-1,3-benzothiazol-2-yldisulfanyl)-3a,7a-dihy...
Create Date: 2005-08-01
CID: 462944

3686. Squalestatin 3; UNII-Y30NG2NO9Q; Y30NG2NO9Q ...
MW:     538.497900 g/mol MF: C25H30O13
IUPAC name: (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetyloxy-5-methyl-3-methyl...
Create Date: 2005-08-01
CID: 460617

3687. 162538-18-3; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-3-((4-hydroxyphenyl)methyl)-13,13-dimethyl-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-; Aminodiol deriv. 15b ...
MW:     559.694200 g/mol MF: C30H45N3O7
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-4-(4-h...
Create Date: 2005-08-01
CID: 455713

3688. 3-Methoxy-8,9-methylenedioxypterocarpan; NSC649972; AC1L9RXT ...
MW:     298.290060 g/mol MF: C17H14O5
Create Date: 2005-03-28
CID: 454895

3689. 2-(hexadecoxymethyl)decane-1,2-diol; 128723-56-8; 2-(Hexadecyloxymethyl)-1,2-decanediol ...
MW:     428.731740 g/mol MF: C27H56O3
IUPAC name: 2-(hexadecoxymethyl)decane-1,2-diol
Create Date: 2005-08-01
CID: 452118

3690. 126614-04-8; 1-(2-Ethoxy-3-hexadecyloxypropyl)-4-hydroxy-1-methyl-piperidinium iodide; Piperidinium,1-[2-ethoxy-3-(hexadecyloxy)propyl]-4-hydroxy-1-methyl-, iodide (1:1) ...
MW:     569.642910 g/mol MF: C27H56INO3
IUPAC name: 1-(2-ethoxy-3-hexadecoxypropyl)-1-methylpiperidin-1-ium-4-ol...
Create Date: 2005-08-01
CID: 452116

3691. 1-Propanaminium, N-(3-hydroxypropyl)-2-methoxy-N,N-dimethyl-3-(octadecylthio)-, iodide, (1)-; 124581-94-8; AC1L9Q3A ...
MW:     587.724390 g/mol MF: C27H58INO2S
IUPAC name: 3-hydroxypropyl-(2-methoxy-3-octadecylsulfanylpropyl)-dimeth...
Create Date: 2005-08-01
CID: 452114

3692. 126614-05-9; 1,3-Dioxolane-4-methanaminium,2-heptadecyl-N-(3-hydroxypropyl)-N,N-dimethyl-, bromide (1:1); ACMC-20ms31 ...
MW:     508.615860 g/mol MF: C26H54BrNO3
IUPAC name: (2-heptadecyl-1,3-dioxolan-4-yl)methyl-(3-hydroxypropyl)-dim...
Create Date: 2005-08-01
CID: 451660

3693. NNGH; MMP Inhibitor Set I; mmp-3 inhibitor ii ...
MW:     316.373300 g/mol MF: C13H20N2O5S
IUPAC name: N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino...
Create Date: 2005-06-24
CID: 448002

3694. BMS-182193, BMS-182,193; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-11-oxo-3,9-bis(phenylmethyl)-, 1,1-dimethylethyl ester, (3S,4R,8R,9S)-; 161302-38-1 ...
MW:     543.694800 g/mol MF: C30H45N3O6
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-3-[(2-...
Create Date: 2005-06-24
CID: 447617

3695. NSC725257; AC1L8RK2; phenylpurine nucleoside analog ...
MW:     270.289860 g/mol MF: C13H14N6O
IUPAC name: [4-[(2,6-diaminopurin-9-yl)methyl]phenyl]methanol
Create Date: 2005-03-26
CID: 406927

3696. NSC-619029; NSC 619029; U 80244 ...
MW:     729.222680 g/mol MF: C41H37ClN6O5
IUPAC name: [8-(chloromethyl)-6-[5-[[6-(diethylamino)-1-benzofuran-2-car...
Create Date: 2005-03-26
CID: 358898

3697. Lenalidomide; 191732-72-6; Revlimid ...
MW:     259.260620 g/mol MF: C13H13N3O3
IUPAC name: 3-(7-amino-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione
Create Date: 2005-08-09
CID: 216326

3698. BRN 2130163; ITF-201; 17332-56-8 ...
MW:     269.338260 g/mol MF: C17H19NO2
IUPAC name: 2-(4-tert-butylanilino)benzoic acid
Create Date: 2005-08-09
CID: 205081

3699. 7221-31-0; N-(4-Nitrophenyl)anthranilic acid; N-p-Nitrophenylanthranilic acid ...
MW:     258.229500 g/mol MF: C13H10N2O4
Create Date: 2005-07-29
CID: 201986

3700. EM-523; AC1L4EDQ; erythromycin analogue (523) ...
MW:     729.938080 g/mol MF: C38H67NO12
IUPAC name: (2R,3R,4S,5R,8R,9S,10S,11R,12S)-5-ethyl-11-[(2S,3R,4S,6R)-4-...
Create Date: 2005-08-09
CID: 184178

3701. Hdmppa; CHEMBL266295; 3-(1,3-dioxoisoindol-2-yl)propyl-[6-[3-(1,3-dioxoisoindol-2-yl)propyl-dimethylazaniumyl]hexyl]-dimethylazanium ...
MW:     548.716160 g/mol MF: C32H44N4O4+2
IUPAC name: 3-(1,3-dioxoisoindol-2-yl)propyl-[6-[3-(1,3-dioxoisoindol-2-...
Create Date: 2005-03-26
CID: 167962

3702. N-o-Nitrophenylanthranilic acid; 2-(2-nitroanilino)benzoic acid; 5933-35-7 ...
MW:     258.229500 g/mol MF: C13H10N2O4
IUPAC name: 2-(2-nitroanilino)benzoic acid
Create Date: 2005-03-26
CID: 101319

3703. N-2-Naphthylanthranilic acid; 2-(2-Naphthylamino)benzoic acid; 4800-34-4 ...
MW:     263.290620 g/mol MF: C17H13NO2
IUPAC name: 2-(naphthalen-2-ylamino)benzoic acid
Create Date: 2005-03-26
CID: 95272

3704. Phosmetoxon; Imidoxon; Oxoimidan ...
MW:     301.255442 g/mol MF: C11H12NO5PS
IUPAC name: 2-(dimethoxyphosphorylsulfanylmethyl)isoindole-1,3-dione
Create Date: 2005-03-27
CID: 77323

3705. Systox sulfoxide; BRN 1712524; Diethyl 2-eththionylethyl thionophosphate ...
MW:     274.337822 g/mol MF: C8H19O4PS2
IUPAC name: diethoxy-(2-ethylsulfinylethoxy)-sulfanylidene-$l^{5}-phosph...
Create Date: 2005-03-27
CID: 21358

3706. (2E,6E)-9-(3,3-dimethyloxiran-2-yl)-N-ethyl-3,7-dimethylnona-2,6-dienamide; Fmc 23509; AC1O5UEJ ...
MW:     279.417660 g/mol MF: C17H29NO2
IUPAC name: (2E,6E)-9-(3,3-dimethyloxiran-2-yl)-N-ethyl-3,7-dimethylnona...
Create Date: 2006-04-28
CID: 6440903

3707. Xylo 2-5A core; (Xyloa2'p)(2)xyloa; AC1MI3EI ...
MW:     925.653204 g/mol MF: C30H37N15O16P2
IUPAC name: [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-[[(2R,3R,4R,5R)-5-(6-...
Create Date: 2005-08-09
CID: 3037723

3708. UNII-1DNW2LG5PU; 1DNW2LG5PU; m-Etaqualone ...
MW:     264.321740 g/mol MF: C17H16N2O
IUPAC name: 3-(3-ethylphenyl)-2-methylquinazolin-4-one
Create Date: 2016-03-16
CID: 118796496

3709. H-PRO-LEU-SER-ARG-THR-LEU-SER-VAL-ALA-ALA-LYS-LYS-OH; 105802-84-4; Glycogen synthase analog peptide
MW:    1270.521320 g/mol MF: C56H103N17O16
IUPAC name: (2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[...
Create Date: 2015-11-11
CID: 92044041

3710. ATX inhibitor 10 analogue 10; BDBM103580
MW:     463.378520 g/mol MF: C17H18Cl2N3O4S2-
IUPAC name: 3-[4-[(5Z)-5-[(3,4-dichlorophenyl)methylidene]-4-oxo-1,3-thi...
Create Date: 2015-10-07
CID: 91899655

3711. Homoisocitrate thia analogue, 3; BDBM23215; (1S,2S)-1-Hydroxy-3-thiabutane-1,2,4-tricarboxylate ...
MW:     221.164700 g/mol MF: C6H5O7S-3
IUPAC name: (2S,3S)-2-(carboxylatomethylsulfanyl)-3-hydroxybutanedioate
Create Date: 2015-10-06
CID: 91895999

3712. BDBM2514; PD 178390 Analog 41; 6-Phenyl-6-phenethyldihydropyrone 13c ...
MW:     532.690240 g/mol MF: C32H36O5S
IUPAC name: 3-[2-tert-butyl-4-(2-hydroxyethoxy)-5-methylphenyl]sulfanyl-...
Create Date: 2015-10-06
CID: 91895598

3713. BDBM2209; PD 178390 Analog 39R; (6R)-3-{[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]sulfanyl}-4-hydroxy-6-(2-phenylethyl)-6-(propan-2-yl)-5,6-dihydro-2H-pyran-2-one ...
MW:     468.648040 g/mol MF: C28H36O4S
IUPAC name: (6R)-3-[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]sulfan...
Create Date: 2015-10-06
CID: 91895594

3714. BDBM2208; PD 178390 Analog 39S; (6S)-3-{[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]sulfanyl}-4-hydroxy-6-(2-phenylethyl)-6-(propan-2-yl)-5,6-dihydro-2H-pyran-2-one ...
MW:     468.648040 g/mol MF: C28H36O4S
IUPAC name: (6S)-3-[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]sulfan...
Create Date: 2015-10-06
CID: 91895593

3715. BDBM2207; PD 178390 Analog 34R; (6R)-6-[2-(4-aminophenyl)ethyl]-3-{[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]sulfanyl}-4-hydroxy-6-(propan-2-yl)-5,6-dihydro-2H-pyran-2-one ...
MW:     483.662680 g/mol MF: C28H37NO4S
IUPAC name: (6R)-6-[2-(4-aminophenyl)ethyl]-3-[2-tert-butyl-4-(hydroxyme...
Create Date: 2015-10-06
CID: 91895592

3716. BDBM2205; PD 178390 Analog 16R; (3-(2-tert-Butyl-4-hydroxymethyl-5-methyl-phenylsulfanyl)-4-hydroxy-6-[2-(4-hydroxypheny)-ethyl]-6-isopropyl-5,6-dihydro-pyran-2-one ...
MW:     484.647440 g/mol MF: C28H36O5S
IUPAC name: (6R)-3-[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]sulfan...
Create Date: 2015-10-06
CID: 91895591

3717. BDBM2203; PD 178390 Analog 42; (3-(2-tert-Butyl-4-(2-hydroxy-ethoxy)-5-methyl-phenylsulfanyl)-4-hydroxy-6-isopropyl-6-phenethyl-5,6-dihydro-pyran-2-one ...
MW:     498.674020 g/mol MF: C29H38O5S
IUPAC name: 3-[2-tert-butyl-4-(2-hydroxyethoxy)-5-methylphenyl]sulfanyl-...
Create Date: 2015-10-06
CID: 91895590

3718. BDBM2200; PD 178390 Analog 39; (3-(2-tert-Butyl-4-hydroxymethyl-5-methyl-phenylsulfanyl)-4-hydroxy-6-isopropyl-6-phenethyl-5,6-dihydro-pyran-2-one ...
MW:     468.648040 g/mol MF: C28H36O4S
IUPAC name: 3-[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]sulfanyl-6-...
Create Date: 2015-10-06
CID: 91895589

3719. BDBM2198; PD 178390 Analog 37; (3-(2-tert-Butyl-5-methyl-phenylsulfanyl)-4-hydroxy-6-isopropyl-6-phenethyl-5,6-dihydro-pyran-2-one ...
MW:     438.622060 g/mol MF: C27H34O3S
IUPAC name: 3-(2-tert-butyl-5-methylphenyl)sulfanyl-6-(2-phenylethyl)-6-...
Create Date: 2015-10-06
CID: 91895588

3720. BDBM2196; PD 178390 Analog 35; 6-[2-(4-Aminophenyl)-ethyl]-(3-(2-tert-butyl-4-hydroxy-methyl-5-methyl-phenylsulfanyl)-4-hydroxy-6-isobutyl-5,6-dihydro-pyran-2-one ...
MW:     497.689260 g/mol MF: C29H39NO4S
IUPAC name: 6-[2-(4-aminophenyl)ethyl]-3-[2-tert-butyl-4-(hydroxymethyl)...
Create Date: 2015-10-06
CID: 91895587

3721. BDBM2192; PD 178390 Analog 31; (3-(2-tert-Butyl-4-(2-hydroxy-ethoxy)-5-methyl-phenylsulfanyl)-6-cyclopropyl-4-hydroxy-6-[2-(4-hydroxy-phenyl)-ethyl]-5,6-dihydro-pyran-2-one ...
MW:     512.657540 g/mol MF: C29H36O6S
IUPAC name: 3-[2-tert-butyl-4-(2-hydroxyethoxy)-5-methylphenyl]sulfanyl-...
Create Date: 2015-10-06
CID: 91895586

3722. BDBM2190; PD 178390 Analog 29; (3-(2-tert-Butyl-4-(2-hydroxy-ethoxy)-5-methyl-phenylsulfanyl)-4-hydroxy-6-[2-(4-hydroxy-phenyl)-ethyl]-6-pentyl-5,6-dihydro-pyran-2-one ...
MW:     542.726580 g/mol MF: C31H42O6S
IUPAC name: 3-[2-tert-butyl-4-(2-hydroxyethoxy)-5-methylphenyl]sulfanyl-...
Create Date: 2015-10-06
CID: 91895585

3723. BDBM2189; PD 178390 Analog 28; (3-(2-tert-Butyl-4-(2-hydroxy-ethoxy)-5-methyl-phenylsulfanyl)-4-hydroxy-6-[2-(4-hydroxy-phenyl)-ethyl]-6-butyl-5,6-dihydro-pyran-2-one ...
MW:     528.700000 g/mol MF: C30H40O6S
IUPAC name: 6-butyl-3-[2-tert-butyl-4-(2-hydroxyethoxy)-5-methylphenyl]s...
Create Date: 2015-10-06
CID: 91895584

3724. BDBM2188; PD 178390 Analog 27; (3-(2-tert-Butyl-4-(2-methoxymethoxy-ethoxy)-5-methyl-phenylsulfanyl)-4-hydroxy-6-[2-(4-hydroxy-phenyl)-ethyl]-6-propyl-5,6-dihydro-pyran-2-one ...
MW:     514.673420 g/mol MF: C29H38O6S
IUPAC name: 3-[2-tert-butyl-4-(2-hydroxyethoxy)-5-methylphenyl]sulfanyl-...
Create Date: 2015-10-06
CID: 91895583

3725. BDBM2180; PD 178390 Analog 19; 3-(2- tert -Butyl-4-hydroxymethyl -5-methyl-phenylsulfanyl)-6-cyclobutyl-4-hydroxy-6-[2-(4-hydroxy-phenyl)-ethyl]-5,6-dihydro-pyran-2-one ...
MW:     496.658140 g/mol MF: C29H36O5S
IUPAC name: 3-[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]sulfanyl-6-...
Create Date: 2015-10-06
CID: 91895582

3726. BDBM2179; PD 178390 Analog 18; (3-(2-tert-Butyl-4-hydroxymethyl-5-methyl-phenylsulfanyl)-6-cyclopropyl-4-hydroxy-6-[2-(4-hydroxy-phenyl)-ethyl]-5,6-dihydro-pyran-2-one ...
MW:     482.631560 g/mol MF: C28H34O5S
IUPAC name: 3-[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]sulfanyl-6-...
Create Date: 2015-10-06
CID: 91895581

3727. BDBM2178; PD 178390 Analog 17; (3-(2-tert-Butyl-4-hydroxymethyl-5-methyl-phenylsulfanyl)-4-hydroxy-6-[2-(4-hydroxy-phenyl)-ethyl]-6-isobutyl-5,6-dihydro-pyran-2-one ...
MW:     498.674020 g/mol MF: C29H38O5S
IUPAC name: 3-[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]sulfanyl-6-...
Create Date: 2015-10-06
CID: 91895580

3728. BDBM2176; PD 178390 Analog 15; (3-(2-tert-Butyl-4-hydroxymethyl-5-methyl-phenylsulfanyl)-4-hydroxy-6-[2-(4-hydroxy-phenyl)-ethyl]-6-pentyl-5,6-dihydro-pyran-2-one ...
MW:     512.700600 g/mol MF: C30H40O5S
IUPAC name: 3-[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]sulfanyl-6-...
Create Date: 2015-10-06
CID: 91895579

3729. BDBM2174; PD 178390 Analog 13; (3-(2-tert-Butyl-4-hydroxymethyl-5-methyl-phenylsulfanyl)-4-hydroxy-6-[2-(4-hydroxy-phenyl)-ethyl]-6-propyl-5,6-dihydro-pyran-2-one ...
MW:     484.647440 g/mol MF: C28H36O5S
IUPAC name: 3-[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]sulfanyl-6-...
Create Date: 2015-10-06
CID: 91895578

3730. BDBM2171; PD 178390 Analog 10; (3-(2-tert-Butyl-5-methyl-phenylsulfanyl)-4-hydroxy-6-[2-(4-hydroxy-phenyl)-ethyl]-5,6-dihydro-pyran-2-one ...
MW:     412.541720 g/mol MF: C24H28O4S
IUPAC name: 3-(2-tert-butyl-5-methylphenyl)sulfanyl-6-[2-(4-hydroxypheny...
Create Date: 2015-10-06
CID: 91895577

3731. BDBM2134; LY300046HCl Analog 19; N-[2-(2-Cyano-6-fluoro-3-methoxyphenethyl)]-N-[2-(5-chloropyridazyl)]thiourea ...
MW:     367.828903 g/mol MF: C15H15ClFN5OS
IUPAC name: 1-(4-chloro-4H-pyridazin-1-yl)-3-[2-(2-cyano-6-fluoro-3-meth...
Create Date: 2015-10-06
CID: 91895569

3732. Fentanyl, 4-N-undecyl analogue; BBKDDKZENHVNFZ-UHFFFAOYSA-N
MW:     386.613780 g/mol MF: C25H42N2O
IUPAC name: N-phenyl-N-(1-undecylpiperidin-4-yl)propanamide
Create Date: 2015-04-28
CID: 91753696

3733. BDBM2181; PD 178390 Analog 20; (3-(2-tert-Butyl-4-hydroxymethyl-5-methyl-phenylsulfanyl)-4-hydroxy-6-[2-(4-hydroxy-phenyl)-ethyl]-6-cyclopentyl-5,6-dihydro-pyran-2-one ...
MW:     510.684720 g/mol MF: C30H38O5S
IUPAC name: 3-[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]sulfanyl-6-...
Create Date: 2015-03-17
CID: 90907626

3734. BDBM2193; PD 178390 Analog 32; (3-(2-tert-Butyl-4-(2-hydroxy-ethoxy)-5-methyl-phenylsulfanyl)-4-hydroxy-6-[2-(4-hydroxy-phenyl)-ethyl]-6-cyclopentyl-5,6-dihydro-pyran-2-one ...
MW:     540.710700 g/mol MF: C31H40O6S
IUPAC name: 3-[2-tert-butyl-4-(2-hydroxyethoxy)-5-methylphenyl]sulfanyl-...
Create Date: 2015-03-16
CID: 90764702

3735. SCHEMBL16104235; XLR11 N-(4-pentenyl) analog; NXTLUQFOTQPMOD-UHFFFAOYSA-N
MW:     309.445180 g/mol MF: C21H27NO
IUPAC name: (1-pent-4-enylindol-3-yl)-(2,2,3,3-tetramethylcyclopropyl)me...
Create Date: 2015-02-13
CID: 90464180

3736. UNII-3A0RU21RME; 3A0RU21RME; p-Etaqualone ...
MW:     264.321740 g/mol MF: C17H16N2O
IUPAC name: 3-(4-ethylphenyl)-2-methylquinazolin-4-one
Create Date: 2014-11-03
CID: 85754639

3737. Fentanyl, 4-N-propyl analogue; CHEMBL2298724; N-(1-Propyl-4-piperidinyl)-N-phenylpropanamide
MW:     274.401140 g/mol MF: C17H26N2O
IUPAC name: N-phenyl-N-(1-propylpiperidin-4-yl)propanamide
Create Date: 2014-07-29
CID: 76320583

3738. CHEMBL2368207; TG(20)C-Galactoside analogue; CHEMBL267948 ...
MW:    1837.132320 g/mol MF: C86H153N3O38
IUPAC name: [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-(6-methylhepta...
Create Date: 2014-04-03
CID: 73349909

3739. ATX inhibitor 10 analogue 15; BDBM103585
MW:     461.407280 g/mol MF: C22H22Cl2N4OS
IUPAC name: (5Z)-5-[(3,4-dichlorophenyl)methylidene]-2-[4-(3-pyridin-2-y...
Create Date: 2014-01-18
CID: 72699333

3740. ATX inhibitor 10 analogue 14; BDBM103584
MW:     433.354120 g/mol MF: C20H18Cl2N4OS
IUPAC name: (5Z)-5-[(3,4-dichlorophenyl)methylidene]-2-[4-(pyridin-4-ylm...
Create Date: 2014-01-18
CID: 72699332

3741. ATX inhibitor 10 analogue 13; BDBM103583
MW:     433.354120 g/mol MF: C20H18Cl2N4OS
IUPAC name: (5Z)-5-[(3,4-dichlorophenyl)methylidene]-2-[4-(pyridin-3-ylm...
Create Date: 2014-01-18
CID: 72699331

3742. ATX inhibitor 10 analogue 12; BDBM103582
MW:     433.354120 g/mol MF: C20H18Cl2N4OS
IUPAC name: (5Z)-5-[(3,4-dichlorophenyl)methylidene]-2-[4-(pyridin-2-ylm...
Create Date: 2014-01-18
CID: 72699330

3743. ATX inhibitor 10 analogue 11; BDBM103581
MW:     432.366060 g/mol MF: C21H19Cl2N3OS
IUPAC name: (5Z)-2-(4-benzylpiperazin-1-yl)-5-[(3,4-dichlorophenyl)methy...
Create Date: 2014-01-18
CID: 72699329

3744. PSTQ Analog, 3{9,13}; BDBM93371
MW:     457.547420 g/mol MF: C25H23N5O2S
IUPAC name: 3-(3,4-dimethylphenyl)sulfonyl-N-[(2-methylphenyl)methyl]tri...
Create Date: 2013-09-18
CID: 71699747

3745. 1,2,3-triazole analogue, 5; SCHEMBL5612852; BDBM17449 ...
MW:     157.171980 g/mol MF: C9H7N3
IUPAC name: 2,3-dihydroindeno[1,2-d]triazole
Create Date: 2012-12-01
CID: 69505329

3746. N-Desethyl-N-propyl Oxybutynin; 1215677-72-7; CTK8G1735 ...
MW:     371.513020 g/mol MF: C23H33NO3
IUPAC name: 4-[ethyl(propyl)amino]but-2-ynyl 2-cyclohexyl-2-hydroxy-2-ph...
Create Date: 2012-07-12
CID: 57369330

3747. CHEMBL569406; BDBM35530; symmetric dicoumarol analogue, 6
MW:     372.275906 g/mol MF: C19H10F2O6
IUPAC name: 6-fluoro-3-[(6-fluoro-4-hydroxy-2-oxochromen-3-yl)methyl]-4-...
Create Date: 2011-12-27
CID: 54736445

3748. CHEMBL583323; BDBM35528; symmetric dicoumarol analogue, 4
MW:     396.346940 g/mol MF: C21H16O8
IUPAC name: 4-hydroxy-3-[(4-hydroxy-6-methoxy-2-oxochromen-3-yl)methyl]-...
Create Date: 2011-12-27
CID: 54736442

3749. CHEMBL571496; BDBM35527; symmetric dicoumarol analogue, 3
MW:     396.346940 g/mol MF: C21H16O8
IUPAC name: 4-hydroxy-3-[(4-hydroxy-5-methoxy-2-oxochromen-3-yl)methyl]-...
Create Date: 2011-12-27
CID: 54736437

3750. CHEMBL568720; BDBM35533; symmetric dicoumarol analogue, 9
MW:     651.879220 g/mol MF: C19H8Br4O6
IUPAC name: 6,8-dibromo-3-[(6,8-dibromo-4-hydroxy-2-oxochromen-3-yl)meth...
Create Date: 2011-12-27
CID: 54736427

3751. CHEMBL572166; BDBM35532; symmetric dicoumarol analogue, 8
MW:     405.185100 g/mol MF: C19H10Cl2O6
IUPAC name: 6-chloro-3-[(6-chloro-4-hydroxy-2-oxochromen-3-yl)methyl]-4-...
Create Date: 2011-12-27
CID: 54736426

3752. CHEMBL576293; BDBM35531; symmetric dicoumarol analogue, 7
MW:     372.275906 g/mol MF: C19H10F2O6
IUPAC name: 7-fluoro-3-[(7-fluoro-4-hydroxy-2-oxochromen-3-yl)methyl]-4-...
Create Date: 2011-12-27
CID: 54736424

3753. BDBM2185; PD 178390 Analog 24; 3-[(2-tert-butyl-4-hydroxy-5-methylphenyl)sulfanyl]-6-cyclohexyl-4-hydroxy-6-[2-(4-hydroxyphenyl)ethyl]-5,6-dihydro-2H-pyran-2-one
MW:     510.684720 g/mol MF: C30H38O5S
IUPAC name: 3-(2-tert-butyl-4-hydroxy-5-methylphenyl)sulfanyl-6-cyclohex...
Create Date: 2011-12-04
CID: 54566313

3754. BDBM2129; LY300046HCl Analog 14; N-[2-(2-Chloro-3-ethoxy-6-fluorophenethyl)]-N-[2-(5-chloropyridazyl)]thiourea ...
MW:     391.291083 g/mol MF: C15H17Cl2FN4OS
IUPAC name: 1-[2-(2-chloro-3-ethoxy-6-fluorophenyl)ethyl]-3-(4-chloro-4H...
Create Date: 2011-12-04
CID: 54551350

3755. BDBM2536; PD 178390 Analog 34; 6-Alkyl-6-phenethyldihydropyrone 13y ...
MW:     483.662680 g/mol MF: C28H37NO4S
IUPAC name: 6-[2-(4-aminophenyl)ethyl]-3-[2-tert-butyl-4-(hydroxymethyl)...
Create Date: 2011-12-04
CID: 54503375

3756. BDBM2534; PD 178390 Analog 12; 6-Alkyl-6-phenethyldihydropyrone 13w ...
MW:     456.594280 g/mol MF: C26H32O5S
IUPAC name: 3-[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]sulfanyl-6-...
Create Date: 2011-12-04
CID: 54362581

3757. BDBM2183; PD 178390 Analog 22; 6-Alkyl-5,6-Dihydropyran-2-one 13 ...
MW:     442.567700 g/mol MF: C25H30O5S
IUPAC name: 3-(2-tert-butyl-4-hydroxy-5-methylphenyl)sulfanyl-6-[2-(4-hy...
Create Date: 2011-12-04
CID: 54046829

3758. BDBM2175; PD 178390 Analog 14; 6-Butyl-(3-(2-tert-butyl-4-hydroxymethyl-5-methyl-phenylsulfanyl)-4-hydroxy-6-[2-(4-hydroxy-phenyl)-ethyl]-5,6-dihydro-pyran-2-one ...
MW:     498.674020 g/mol MF: C29H38O5S
IUPAC name: 6-butyl-3-[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]sul...
Create Date: 2011-12-04
CID: 53982218

3759. BDBM2535; PD 178390 Analog 36; 6-Alkyl-6-phenethyldihydropyrone 13x ...
MW:     523.726540 g/mol MF: C31H41NO4S
IUPAC name: 6-[2-(4-aminophenyl)ethyl]-3-[2-tert-butyl-4-(hydroxymethyl)...
Create Date: 2011-12-04
CID: 53971203

3760. BDBM2187; PD 178390 Analog 26; (3-(2-tert-Butyl-4-(2-methoxymethoxy-ethoxy)-5-methyl-phenylsulfanyl)-4-hydroxy-6-[2-(4-hydroxy-phenyl)-ethyl]-6-methyl-5,6-dihydro-pyran-2-one ...
MW:     530.672820 g/mol MF: C29H38O7S
IUPAC name: 3-[2-tert-butyl-4-[2-(methoxymethoxy)ethoxy]-5-methylphenyl]...
Create Date: 2011-12-04
CID: 53948161

3761. BDBM2191; PD 178390 Analog 30; (3-(2-tert-Butyl-4-(2-hydroxy-ethoxy)-5-methyl-phenylsulfanyl)-4-hydroxy-6-[2-(4-hydroxy-phenyl)-ethyl]-6-isopropyl-5,6-dihydro-pyran-2-one ...
MW:     514.673420 g/mol MF: C29H38O6S
IUPAC name: 3-[2-tert-butyl-4-(2-hydroxyethoxy)-5-methylphenyl]sulfanyl-...
Create Date: 2011-12-04
CID: 53898320

3762. BDBM2532; PD 178390 Analog 21; 6-Alkyl-6-phenethyldihydropyrone 13u ...
MW:     524.711300 g/mol MF: C31H40O5S
IUPAC name: 3-[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]sulfanyl-6-...
Create Date: 2011-12-04
CID: 53831752

3763. BDBM2515; PD 178390 Analog 38; 6-Phenyl-6-phenethyldihydropyrone 13d ...
MW:     502.664260 g/mol MF: C31H34O4S
IUPAC name: 3-[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]sulfanyl-6-...
Create Date: 2011-12-04
CID: 53754215

3764. BDBM2524; PD 178390 Analog 33; 6-Phenyl-6-phenethyldihydropyrone 13m ...
MW:     517.678900 g/mol MF: C31H35NO4S
IUPAC name: 6-[2-(4-aminophenyl)ethyl]-3-[2-tert-butyl-4-(hydroxymethyl)...
Create Date: 2011-12-04
CID: 53734951

3765. BDBM2186; PD 178390 Analog 25; 3-{[2-tert-butyl-4-(2-hydroxyethoxy)-5-methylphenyl]sulfanyl}-4-hydroxy-6-[2-(4-hydroxyphenyl)ethyl]-6-methyl-5,6-dihydro-2H-pyran-2-one
MW:     486.620260 g/mol MF: C27H34O6S
IUPAC name: 3-[2-tert-butyl-4-(2-hydroxyethoxy)-5-methylphenyl]sulfanyl-...
Create Date: 2011-12-04
CID: 53698462

3766. BDBM2533; PD 178390 Analog 16; 6-Alkyl-6-phenethyldihydropyrone 13v ...
MW:     484.647440 g/mol MF: C28H36O5S
IUPAC name: 3-[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]sulfanyl-6-...
Create Date: 2011-12-03
CID: 53634351

3767. BDBM2204; PD 178390 Analog 16S; (3-(2-tert-Butyl-4-hydroxymethyl-5-methyl-phenylsulfanyl)-4-hydroxy-6-[2-(4-hydroxypheny)-ethyl]-6-isopropyl-5,6-dihydro-pyran-2-one ...
MW:     484.647440 g/mol MF: C28H36O5S
IUPAC name: (6S)-3-[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]sulfan...
Create Date: 2011-12-03
CID: 53634350

3768. SCHEMBL8018278; PSTQ Analog, 3{1,40}; BDBM93396 ...
MW:     353.398300 g/mol MF: C17H15N5O2S
IUPAC name: 3-(benzenesulfonyl)-N,N-dimethyltriazolo[1,5-a]quinazolin-5-...
Create Date: 2010-09-07
CID: 46863499

3769. 3-[(4-ethylphenyl)sulfonyl]-N-(2-methylcyclohexyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine; PSTQ Analog, 3{3,27}; BDBM93377 ...
MW:     449.568480 g/mol MF: C24H27N5O2S
IUPAC name: 3-(4-ethylphenyl)sulfonyl-N-(2-methylcyclohexyl)triazolo[1,5...
Create Date: 2010-09-07
CID: 46862819

3770. PSTQ Analog, 3{1,23}; BDBM93365; MolPort-019-717-157 ...
MW:     416.455740 g/mol MF: C21H16N6O2S
IUPAC name: 3-(benzenesulfonyl)-N-(pyridin-3-ylmethyl)triazolo[1,5-a]qui...
Create Date: 2010-09-07
CID: 46862818

3771. PSTQ Analog, 3{1,42}; BDBM93397; ZINC85393423
MW:     410.492680 g/mol MF: C20H22N6O2S
IUPAC name: N'-[3-(benzenesulfonyl)triazolo[1,5-a]quinazolin-5-yl]-N,N,N...
Create Date: 2010-09-07
CID: 46862187

3772. Phosphonate analogue of Lipid A; CHEMBL1160316
MW:    1309.727622 g/mol MF: C68H129N2O19P
IUPAC name: [(3S,5S)-5-hydroxy-6-[[(3S,5S)-5-hydroxy-6-(hydroxymethyl)-3...
Create Date: 2009-11-19
CID: 44305329

3773. CHEMBL556087; sulfone tricyclic analogue, 21; BDBM29808
MW:     497.606440 g/mol MF: C26H31N3O5S
Create Date: 2009-08-19
CID: 44143286

3774. CHEMBL558078; SCHEMBL8256545; sulfone tricyclic analogue, 20 ...
MW:     495.590560 g/mol MF: C26H29N3O5S
Create Date: 2009-08-19
CID: 44143285

3775. sulfone tricyclic analogue, 19; BDBM29806
MW:     541.659000 g/mol MF: C28H35N3O6S
Create Date: 2009-08-19
CID: 44143284

3776. CHEMBL554146; sulfone tricyclic analogue, 18; BDBM29805
MW:     615.663090 g/mol MF: C31H32F3N3O5S
Create Date: 2009-08-19
CID: 44143283

3777. AdoMet substrate analogue, 22c; BDBM28451; 3-({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl}(methyl)amino)-N''-hydroxypropanimidamide
MW:     366.375680 g/mol MF: C14H22N8O4
IUPAC name: 3-[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-...
Create Date: 2009-05-20
CID: 25263229

3778. JMC516547 Compound 5; CHEMBL494890; SCHEMBL2166460 ...
MW:     280.327740 g/mol MF: C15H16N6
IUPAC name: 4-(2-amino-6-piperazin-1-ylpyrimidin-4-yl)benzonitrile
Create Date: 2009-01-19
CID: 25130576

3779. A-846714; JMC516547 Compound 2; 2-Aminopyrimidine analog., 4 ...
MW:     294.354320 g/mol MF: C16H18N6
IUPAC name: 4-[2-amino-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]benzonit...
Create Date: 2009-01-19
CID: 25130235

3780. CHEMBL488699; SCHEMBL10046881; BDBM24617 ...
MW:     406.412963 g/mol MF: C21H19FN6O2
IUPAC name: 1-ethyl-3-[4-(3-fluoropyridin-2-yl)-6-(1-methyl-2-oxopyridin...
Create Date: 2008-10-21
CID: 24971307

3781. CHEMBL519397; SCHEMBL8997734; BDBM24616 ...
MW:     430.462480 g/mol MF: C22H22N8O2
IUPAC name: N-cyclopropyl-1-[2-(ethylcarbamoylamino)-7-pyridin-2-yl-3H-b...
Create Date: 2008-10-21
CID: 24971306

3782. CHEMBL487664; BDBM24610; Benzimidazole urea analogue, 14 ...
MW:     358.396520 g/mol MF: C20H18N6O
IUPAC name: 1-(4,6-dipyridin-3-yl-1H-benzimidazol-2-yl)-3-ethylurea
Create Date: 2008-10-21
CID: 24971305

3783. Benzimidazole urea analogue, 4; CHEMBL512701; BDBM24600 ...
MW:     282.300560 g/mol MF: C14H14N6O
IUPAC name: 1-ethyl-3-(6-pyrimidin-5-yl-1H-benzimidazol-2-yl)urea
Create Date: 2008-10-21
CID: 24971304

3784. CHEMBL459876; pyridine N-oxide analogue, 49; SCHEMBL14017868 ...
MW:     458.416346 g/mol MF: C25H16F2N4O3
IUPAC name: 6-(4-fluorophenyl)-N-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4...
Create Date: 2008-09-22
CID: 24901690

3785. CHEMBL478298; Modified amino acid analog, 10; BDBM24285 ...
MW:     328.362400 g/mol MF: C18H20N2O4
IUPAC name: (3S)-3-amino-6-oxo-6-(4-phenoxyanilino)hexanoic acid
Create Date: 2008-09-22
CID: 24901630

3786. CHEMBL515470; Modified amino acid analog, 9g; BDBM24284 ...
MW:     379.409140 g/mol MF: C21H21N3O4
IUPAC name: (2S)-2-amino-N'-[4-[4-(furan-3-yl)phenoxy]phenyl]pentanediam...
Create Date: 2008-09-22
CID: 24901629

3787. CHEMBL476895; Modified amino acid analog, 9f; BDBM24283 ...
MW:     379.409140 g/mol MF: C21H21N3O4
IUPAC name: (2S)-2-amino-5-oxo-5-[4-(4-pyrrol-1-ylphenoxy)anilino]pentan...
Create Date: 2008-09-22
CID: 24901628

3788. CHEMBL479157; Modified amino acid analog, 9e; BDBM24282 ...
MW:     327.377640 g/mol MF: C18H21N3O3
IUPAC name: (2S)-2-amino-N'-[4-(4-methylphenoxy)phenyl]pentanediamide
Create Date: 2008-09-22
CID: 24901627

3789. CHEMBL446500; Modified amino acid analog, 9d; BDBM24281 ...
MW:     327.377640 g/mol MF: C18H21N3O3
IUPAC name: (2S)-2-amino-N'-[4-(3-methylphenoxy)phenyl]pentanediamide
Create Date: 2008-09-22
CID: 24901626

3790. CHEMBL478983; Modified amino acid analog, 9c; BDBM24280 ...
MW:     327.377640 g/mol MF: C18H21N3O3
IUPAC name: (2S)-2-amino-N'-[4-(2-methylphenoxy)phenyl]pentanediamide
Create Date: 2008-09-22
CID: 24901625

3791. CHEMBL477688; Modified amino acid analog, 9b; BDBM24279 ...
MW:     319.398700 g/mol MF: C17H25N3O3
IUPAC name: (2S)-2-amino-N'-(4-cyclohexyloxyphenyl)pentanediamide
Create Date: 2008-09-22
CID: 24901624

3792. CHEMBL477515; Modified amino acid analog, 9a; BDBM24278 ...
MW:     266.293020 g/mol MF: C13H18N2O4
IUPAC name: methyl (2S)-2-amino-5-(4-methoxyanilino)-5-oxopentanoate
Create Date: 2008-09-22
CID: 24901623

3793. CHEMBL477514; Modified amino acid analog, 8l; BDBM24277 ...
MW:     358.388380 g/mol MF: C19H22N2O5
IUPAC name: (2S)-2-amino-5-[4-(2-hydroxy-2-phenylethoxy)anilino]-5-oxope...
Create Date: 2008-09-22
CID: 24901622

3794. CHEMBL518118; Modified amino acid analog, 8k; BDBM24276 ...
MW:     356.372500 g/mol MF: C19H20N2O5
IUPAC name: (2S)-2-amino-5-oxo-5-(4-phenacyloxyanilino)pentanoic acid
Create Date: 2008-09-22
CID: 24901621

3795. CHEMBL477513; Modified amino acid analog, 8j; BDBM24275 ...
MW:     356.415560 g/mol MF: C20H24N2O4
IUPAC name: (2S)-2-amino-5-oxo-5-[4-(3-phenylpropoxy)anilino]pentanoic a...
Create Date: 2008-09-22
CID: 24901620

3796. CHEMBL478993; Modified amino acid analog, 8i; BDBM24274 ...
MW:     342.388980 g/mol MF: C19H22N2O4
IUPAC name: (2S)-2-amino-5-oxo-5-[4-(2-phenylethoxy)anilino]pentanoic ac...
Create Date: 2008-09-22
CID: 24901619

3797. CHEMBL478380; Modified amino acid analog, 8h; BDBM24273 ...
MW:     341.404220 g/mol MF: C19H23N3O3
IUPAC name: methyl (2S)-2-amino-5-[4-(N-methylanilino)anilino]-5-oxopent...
Create Date: 2008-09-22
CID: 24901618

3798. CHEMBL517211; Modified amino acid analog, 8g; BDBM24272 ...
MW:     313.351060 g/mol MF: C17H19N3O3
IUPAC name: (2S)-2-amino-5-(4-anilinoanilino)-5-oxopentanoic acid
Create Date: 2008-09-22
CID: 24901617

3799. CHEMBL478379; Modified amino acid analog, 8f; BDBM24271 ...
MW:     311.378240 g/mol MF: C18H21N3O2
IUPAC name: (2S)-2-amino-N'-(4-benzylphenyl)pentanediamide
Create Date: 2008-09-22
CID: 24901616

3800. CHEMBL442816; Modified amino acid analog, 8e; BDBM24270 ...
MW:     314.335820 g/mol MF: C17H18N2O4
IUPAC name: (2S)-2-amino-5-oxo-5-(4-phenoxyanilino)pentanoic acid
Create Date: 2008-09-22
CID: 24901615

3801. CHEMBL478551; Modified amino acid analog, 8d; BDBM24269 ...
MW:     314.339120 g/mol MF: C16H18N4O3
IUPAC name: (2S)-2-amino-N'-(6-phenoxypyridin-3-yl)pentanediamide
Create Date: 2008-09-22
CID: 24901614

3802. CHEMBL476901; Modified amino acid analog, 8c; BDBM24268 ...
MW:     342.388980 g/mol MF: C19H22N2O4
IUPAC name: methyl (2S)-2-amino-5-oxo-5-(3-phenylmethoxyanilino)pentanoa...
Create Date: 2008-09-22
CID: 24901613

3803. CHEMBL478549; Modified amino acid analog, 8b; BDBM24267 ...
MW:     286.329020 g/mol MF: C15H18N4O2
IUPAC name: (2S)-2-amino-N'-(4-pyrrol-1-ylphenyl)pentanediamide
Create Date: 2008-09-22
CID: 24901612

3804. CHEMBL478548; Modified amino acid analog, 8a; BDBM24266 ...
MW:     221.255700 g/mol MF: C11H15N3O2
IUPAC name: (2S)-2-amino-N'-phenylpentanediamide
Create Date: 2008-09-22
CID: 24901611

3805. CHEMBL478373; Modified amino acid analog, 7c; BDBM24265 ...
MW:     312.406060 g/mol MF: C19H24N2O2
IUPAC name: 4-(dimethylamino)-N-(4-phenylmethoxyphenyl)butanamide
Create Date: 2008-09-22
CID: 24901610

3806. CHEMBL478393; Modified amino acid analog, 7b; BDBM24264 ...
MW:     298.379480 g/mol MF: C18H22N2O2
IUPAC name: 4-(methylamino)-N-(4-phenylmethoxyphenyl)butanamide
Create Date: 2008-09-22
CID: 24901609

3807. CHEMBL479156; Modified amino acid analog, 6d; BDBM24262 ...
MW:     343.377040 g/mol MF: C18H21N3O4
IUPAC name: (2S)-2-amino-N-hydroxy-N'-(4-phenylmethoxyphenyl)pentanediam...
Create Date: 2008-09-22
CID: 24901608

3808. CHEMBL478717; Modified amino acid analog, 6c; BDBM24261 ...
MW:     327.377640 g/mol MF: C18H21N3O3
IUPAC name: (2S)-2-amino-N'-(4-phenylmethoxyphenyl)pentanediamide
Create Date: 2008-09-22
CID: 24901607

3809. CHEMBL478543; Modified amino acid analog, 6b; BDBM24260
MW:     384.468720 g/mol MF: C22H28N2O4
IUPAC name: tert-butyl (2S)-2-amino-5-oxo-5-(4-phenylmethoxyanilino)pent...
Create Date: 2008-09-22
CID: 24901606

3810. CHEMBL517974; Modified amino acid analog, 6a; BDBM24259 ...
MW:     342.388980 g/mol MF: C19H22N2O4
IUPAC name: methyl (2S)-2-amino-5-oxo-5-(4-phenylmethoxyanilino)pentanoa...
Create Date: 2008-09-22
CID: 24901605

3811. CHEMBL28897; BDBM22200; GBR 12935 Analogue, 37 ...
MW:     474.584686 g/mol MF: C30H32F2N2O
IUPAC name: 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-(3,4-dihydronaphth...
Create Date: 2008-07-07
CID: 24825337

3812. CHEMBL511756; BDBM22195; GBR 12935 Analogue, 24 ...
MW:     414.539300 g/mol MF: C27H30N2O2
IUPAC name: 2-[4-(2-benzhydryloxyethyl)piperazin-1-yl]-1-phenylethanone
Create Date: 2008-07-07
CID: 24825334

3813. CHEMBL512280; BDBM22193; GBR 12935 Analogue, 22 ...
MW:     444.608340 g/mol MF: C29H36N2O2
IUPAC name: 1-[4-(2-benzhydryloxyethyl)piperazin-1-yl]-2-methyl-3-phenyl...
Create Date: 2008-07-07
CID: 24825333

3814. CHEMBL468376; BDBM22192; GBR 12935 Analogue, 21 ...
MW:     480.589266 g/mol MF: C29H34F2N2O2
IUPAC name: 1-[4-[2-[bis(4-fluorophenyl)methoxy]ethyl]piperazin-1-yl]-2-...
Create Date: 2008-07-07
CID: 24825332

3815. CHEMBL466733; BDBM22191; GBR 12935 Analogue, 20 ...
MW:     426.593060 g/mol MF: C29H34N2O
IUPAC name: 1-(2-benzhydryloxyethyl)-4-(2-benzylprop-2-enyl)piperazine
Create Date: 2008-07-07
CID: 24825331

3816. CHEMBL466538; BDBM22190; GBR 12935 Analogue, 19 ...
MW:     462.573986 g/mol MF: C29H32F2N2O
IUPAC name: 1-(2-benzylprop-2-enyl)-4-[2-[bis(4-fluorophenyl)methoxy]eth...
Create Date: 2008-07-07
CID: 24825330

3817. CHEMBL466750; BDBM22189; GBR 12935 Analogue, 18 ...
MW:     428.565880 g/mol MF: C28H32N2O2
IUPAC name: 1-[4-(2-benzhydryloxyethyl)piperazin-1-yl]-3-phenylpropan-2-...
Create Date: 2008-07-07
CID: 24825329

3818. CHEMBL469165; BDBM22187; GBR 12935 Analogue, 16 ...
MW:     444.608340 g/mol MF: C29H36N2O2
IUPAC name: 4-[4-(2-benzhydryloxyethyl)piperazin-1-yl]-2-phenylbutan-2-o...
Create Date: 2008-07-07
CID: 24825328

3819. CHEMBL467757; BDBM22185; GBR 12935 Analogue, 14 ...
MW:     426.593060 g/mol MF: C29H34N2O
IUPAC name: 1-(2-benzhydryloxyethyl)-4-(3-phenylbut-3-enyl)piperazine
Create Date: 2008-07-07
CID: 24825327

3820. CHEMBL467585; BDBM22184; GBR 12935 Analogue, 13 ...
MW:     462.573986 g/mol MF: C29H32F2N2O
IUPAC name: 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-(3-phenylbut-3-eny...
Create Date: 2008-07-07
CID: 24825326

3821. Indanylacetic Acid Analog, 9p; CHEMBL374346; SCHEMBL1400561 ...
MW:     365.422320 g/mol MF: C22H23NO4
IUPAC name: 2-[(1S)-5-[3-(1H-indol-6-yloxy)propoxy]-2,3-dihydro-1H-inden...
Create Date: 2008-05-08
CID: 24776394

3822. Indanylacetic Acid Analog, 9o; CHEMBL223356; SCHEMBL1400556 ...
MW:     379.448900 g/mol MF: C23H25NO4
IUPAC name: 2-[(1S)-5-[3-[(2-methyl-1H-indol-5-yl)oxy]propoxy]-2,3-dihyd...
Create Date: 2008-05-08
CID: 24776393

3823. Indanylacetic Acid Analog, 9n; CHEMBL219872; SCHEMBL1400254 ...
MW:     405.486180 g/mol MF: C25H27NO4
IUPAC name: 2-[(1S)-5-[3-[(4-prop-2-enyl-1H-indol-5-yl)oxy]propoxy]-2,3-...
Create Date: 2008-05-08
CID: 24776392

3824. Indanylacetic Acid Analog, 9m; CHEMBL373591; SCHEMBL1400688 ...
MW:     421.528640 g/mol MF: C26H31NO4
IUPAC name: 2-[(1S)-5-[3-(1-methyl-4-propylindol-5-yl)oxypropoxy]-2,3-di...
Create Date: 2008-05-08
CID: 24776391

3825. Indanylacetic Acid Analog, 9l; CHEMBL427237; SCHEMBL1400408 ...
MW:     407.502060 g/mol MF: C25H29NO4
IUPAC name: 2-[(1S)-5-[3-[(4-propyl-1H-indol-5-yl)oxy]propoxy]-2,3-dihyd...
Create Date: 2008-05-08
CID: 24776390

3826. Indanylacetic Acid Analog, 9k; CHEMBL219935; SCHEMBL1400393 ...
MW:     379.448900 g/mol MF: C23H25NO4
IUPAC name: 2-[(1S)-5-[3-[(4-methyl-1H-indol-5-yl)oxy]propoxy]-2,3-dihyd...
Create Date: 2008-05-08
CID: 24776389

3827. Indanylacetic Acid Analog, 9j; CHEMBL223629; SCHEMBL1401143 ...
MW:     379.448900 g/mol MF: C23H25NO4
IUPAC name: 2-[(1S)-5-[3-(1-methylindol-5-yl)oxypropoxy]-2,3-dihydro-1H-...
Create Date: 2008-05-08
CID: 24776388

3828. Indanylacetic Acid Analog, 9i; CHEMBL221100; SCHEMBL1400602 ...
MW:     365.422320 g/mol MF: C22H23NO4
IUPAC name: 2-[(1S)-5-[3-(1H-indol-5-yloxy)propoxy]-2,3-dihydro-1H-inden...
Create Date: 2008-05-08
CID: 24776387

3829. Indanylacetic Acid Analog, 9h; CHEMBL219723; SCHEMBL1400578 ...
MW:     380.433660 g/mol MF: C23H24O5
IUPAC name: 2-[(1S)-5-[3-[(3-methyl-1-benzofuran-6-yl)oxy]propoxy]-2,3-d...
Create Date: 2008-05-08
CID: 24776386

3830. Indanylacetic Acid Analog, 9g; CHEMBL426529; SCHEMBL1400543 ...
MW:     367.395140 g/mol MF: C21H21NO5
IUPAC name: 2-[(1S)-5-[3-(1,3-benzoxazol-6-yloxy)propoxy]-2,3-dihydro-1H...
Create Date: 2008-05-08
CID: 24776385

3831. Indanylacetic Acid Analog, 9f; CHEMBL219610; SCHEMBL1400342 ...
MW:     453.408390 g/mol MF: C22H22F3NO6
IUPAC name: 2-[(1S)-5-[3-[[3-hydroxy-3-(trifluoromethyl)-2H-1,2-benzoxaz...
Create Date: 2008-05-08
CID: 24776384

3832. Indanylacetic Acid Analog, 9e; CHEMBL223247; SCHEMBL1400386 ...
MW:     367.395140 g/mol MF: C21H21NO5
IUPAC name: 2-[(1S)-5-[3-(1,2-benzoxazol-6-yloxy)propoxy]-2,3-dihydro-1H...
Create Date: 2008-05-08
CID: 24776383

3833. Indanylacetic Acid Analog, 9d; CHEMBL375373; SCHEMBL1400175 ...
MW:     381.421720 g/mol MF: C22H23NO5
IUPAC name: 2-[(1S)-5-[3-[(3-methyl-1,2-benzoxazol-6-yl)oxy]propoxy]-2,3...
Create Date: 2008-05-08
CID: 24776382

3834. Indanylacetic Acid Analog, 9c; CHEMBL220205; SCHEMBL3025900 ...
MW:     395.448300 g/mol MF: C23H25NO5
IUPAC name: 2-[(1S)-5-[3-[(3,7-dimethyl-1,2-benzoxazol-6-yl)oxy]propoxy]...
Create Date: 2008-05-08
CID: 24776381

3835. Indanylacetic Acid Analog, 9a; CHEMBL426883; BDBM21826 ...
MW:     477.472850 g/mol MF: C25H26F3NO5
IUPAC name: 2-[(1S)-5-[3-[[7-propyl-3-(trifluoromethyl)-1,2-benzoxazol-6...
Create Date: 2008-05-08
CID: 24776380

3836. CHEMBL430006; T0901317 analogue, 12; BDBM21673 ...
MW:     581.347722 g/mol MF: C19H12F13NO3S
IUPAC name: N-[4-(1,1,1,3,3,4,4,5,5,5-decafluoro-2-hydroxypentan-2-yl)ph...
Create Date: 2008-05-08
CID: 24776340

3837. CHEMBL396953; T0901317 analogue, 11; BDBM21672 ...
MW:     513.452099 g/mol MF: C24H17F6NO3S
IUPAC name: N-(2,2,2-trifluoroethyl)-N-[4-(1,1,1-trifluoro-2-hydroxy-4-p...
Create Date: 2008-05-08
CID: 24776339

3838. CHEMBL242293; T0901317 analogue, 10; BDBM21671 ...
MW:     489.430699 g/mol MF: C22H17F6NO3S
IUPAC name: N-(2,2,2-trifluoroethyl)-N-[4-(2,2,2-trifluoro-1-hydroxy-1-p...
Create Date: 2008-05-08
CID: 24776338

3839. T0901317 analogue, 8; CHEMBL242291; BDBM21669 ...
MW:     357.347470 g/mol MF: C16H14F3NO3S
IUPAC name: N-(4-acetylphenyl)-N-(2,2,2-trifluoroethyl)benzenesulfonamid...
Create Date: 2008-05-08
CID: 24776337

3840. T0901317 analogue, 7; CHEMBL396041; BDBM21668 ...
MW:     359.363350 g/mol MF: C16H16F3NO3S
IUPAC name: N-[4-(1-hydroxyethyl)phenyl]-N-(2,2,2-trifluoroethyl)benzene...
Create Date: 2008-05-08
CID: 24776336

3841. T0901317 analogue, 6; CHEMBL389979; BDBM21667 ...
MW:     345.336770 g/mol MF: C15H14F3NO3S
IUPAC name: N-[4-(hydroxymethyl)phenyl]-N-(2,2,2-trifluoroethyl)benzenes...
Create Date: 2008-05-08
CID: 24776335

3842. T0901317 analogue, 5; CHEMBL242528; BDBM21666 ...
MW:     455.414479 g/mol MF: C19H19F6NO3S
IUPAC name: N-(2,2,2-trifluoroethyl)-N-[4-(1,1,1-trifluoro-2-hydroxypent...
Create Date: 2008-05-08
CID: 24776334

3843. T0901317 analogue, 3; CHEMBL242527; SCHEMBL13651537 ...
MW:     427.361319 g/mol MF: C17H15F6NO3S
IUPAC name: N-(2,2,2-trifluoroethyl)-N-[4-(1,1,1-trifluoro-2-hydroxyprop...
Create Date: 2008-05-08
CID: 24776332

3844. T0901317 analogue, 2; CHEMBL242526; BDBM21663 ...
MW:     413.334739 g/mol MF: C16H13F6NO3S
IUPAC name: N-(2,2,2-trifluoroethyl)-N-[4-(2,2,2-trifluoro-1-hydroxyethy...
Create Date: 2008-05-08
CID: 24776331

3845. Spiro-indolinone analogue, 92; CHEMBL411521; SCHEMBL2487272 ...
MW:     465.885700 g/mol MF: C24H20ClN3O5
IUPAC name: 2-[5-chloro-1'-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methyl]-2...
Create Date: 2008-05-08
CID: 24776299

3846. Spiro-indolinone analogue, 91; CHEMBL259940; SCHEMBL2482558 ...
MW:     465.885700 g/mol MF: C24H20ClN3O5
IUPAC name: 2-[5-chloro-1'-[(3-methyl-5-phenyl-1,2-oxazol-4-yl)methyl]-2...
Create Date: 2008-05-08
CID: 24776298

3847. Spiro-indolinone analogue, 90; CHEMBL409524; SCHEMBL2484341 ...
MW:     437.248503 g/mol MF: C20H15Cl2FN2O4
IUPAC name: 2-[5-chloro-1'-[(5-chloro-2-fluorophenyl)methyl]-2,2'-dioxos...
Create Date: 2008-05-08
CID: 24776297

3848. Spiro-indolinone analogue, 89; CHEMBL258751; SCHEMBL2480425 ...
MW:     384.812980 g/mol MF: C20H17ClN2O4
IUPAC name: 2-(1'-benzyl-5-chloro-2,2'-dioxospiro[indole-3,4'-pyrrolidin...
Create Date: 2008-05-08
CID: 24776296

3849. Spiro-indolinone analogue, 87; CHEMBL411513; SCHEMBL2483157 ...
MW:     479.869220 g/mol MF: C24H18ClN3O6
IUPAC name: 2-[5-chloro-1'-[(3-methyl-5-phenyl-1,2-oxazol-4-yl)methyl]-2...
Create Date: 2008-05-08
CID: 24776295

3850. Spiro-indolinone analogue, 86; CHEMBL262887; SCHEMBL2484056 ...
MW:     479.869220 g/mol MF: C24H18ClN3O6
IUPAC name: 2-[5-chloro-1'-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methyl]-2...
Create Date: 2008-05-08
CID: 24776294

3851. Spiro-indolinone analogue, 79; CHEMBL261624; SCHEMBL2484467 ...
MW:     496.856680 g/mol MF: C23H17ClN4O7
IUPAC name: 2-[5-chloro-1'-[[5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-yl]me...
Create Date: 2008-05-08
CID: 24776293

3852. Spiro-indolinone analogue, 78; CHEMBL263662; SCHEMBL2486693 ...
MW:     516.353300 g/mol MF: C23H15Cl2N3O5S
IUPAC name: 2-[5-chloro-1'-[[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl]...
Create Date: 2008-05-08
CID: 24776292

3853. Spiro-indolinone analogue, 77; CHEMBL411953; SCHEMBL2483659 ...
MW:     516.353300 g/mol MF: C23H15Cl2N3O5S
IUPAC name: 2-[5-chloro-1'-[[2-(3-chlorophenyl)-1,3-thiazol-4-yl]methyl]...
Create Date: 2008-05-08
CID: 24776291

3854. Spiro-indolinone analogue, 51; CHEMBL259506; SCHEMBL2480348 ...
MW:     426.849660 g/mol MF: C22H19ClN2O5
IUPAC name: ethyl 2-(1'-benzyl-5-chloro-2,2',5'-trioxospiro[indole-3,3'-...
Create Date: 2008-05-08
CID: 24776290

3855. Spiro-indolinone analogue, 18; CHEMBL264142; SCHEMBL2480733 ...
MW:     410.395063 g/mol MF: C22H19FN2O5
IUPAC name: 4-(1'-benzyl-5-fluoro-2,2',5'-trioxospiro[indole-3,3'-pyrrol...
Create Date: 2008-05-08
CID: 24776289

3856. Spiro-indolinone analogue, 17; CHEMBL262100; SCHEMBL2482097 ...
MW:     360.336383 g/mol MF: C18H17FN2O5
IUPAC name: 4-(5-fluoro-2,2',5'-trioxo-1'-prop-2-enylspiro[indole-3,3'-p...
Create Date: 2008-05-08
CID: 24776288

3857. Spiro-indolinone analogue, 16; CHEMBL409332; BDBM21555 ...
MW:     334.299103 g/mol MF: C16H15FN2O5
IUPAC name: 4-(5-fluoro-1'-methyl-2,2',5'-trioxospiro[indole-3,3'-pyrrol...
Create Date: 2008-05-08
CID: 24776287

3858. Spiro-indolinone analogue, 14; CHEMBL428261; SCHEMBL2483153 ...
MW:     366.753100 g/mol MF: C16H15ClN2O6
IUPAC name: 2-[5-chloro-1'-(2-methoxyethyl)-2,2',5'-trioxospiro[indole-3...
Create Date: 2008-05-08
CID: 24776286

3859. Spiro-indolinone analogue, 13; CHEMBL261435; BDBM21552 ...
MW:     322.700540 g/mol MF: C14H11ClN2O5
IUPAC name: 2-(5-chloro-1'-methyl-2,2',5'-trioxospiro[indole-3,3'-pyrrol...
Create Date: 2008-05-08
CID: 24776285

3860. Spiro-indolinone analogue, 12; CHEMBL261467; BDBM21551 ...
MW:     354.787000 g/mol MF: C19H15ClN2O3
IUPAC name: 1'-benzyl-5-chloro-1-methylspiro[indole-3,3'-pyrrolidine]-2,...
Create Date: 2008-05-08
CID: 24776284

3861. Spiro-indolinone analogue, 11; CHEMBL261468; SCHEMBL2485478 ...
MW:     376.790980 g/mol MF: C18H17ClN2O5
IUPAC name: 4-(5-chloro-2,2',5'-trioxo-1'-prop-2-enylspiro[indole-3,3'-p...
Create Date: 2008-05-08
CID: 24776283

3862. Spiro-indolinone analogue, 10; CHEMBL261763; BDBM21549 ...
MW:     380.324483 g/mol MF: C17H17FN2O7
IUPAC name: 2-[5-fluoro-1'-(2-methoxyethoxymethyl)-2,2',5'-trioxospiro[i...
Create Date: 2008-05-08
CID: 24776282

3863. Amino dicarboxylate analogue, 7; BDBM21491; (2S)-2-{[(1S)-1-carboxy-2-[1-(2-cyclohexylpropan-2-yl)-1H-imidazol-5-yl]ethyl]amino}-4-methylpentanoic acid
MW:     393.520300 g/mol MF: C21H35N3O4
IUPAC name: (2S)-2-[[(1S)-1-carboxy-2-[3-(2-cyclohexylpropan-2-yl)imidaz...
Create Date: 2008-05-08
CID: 24776248

3864. Amino dicarboxylate analogue, 9; BDBM21482; N-[(S)-1-Carboxy-2-[1-(4-chlorobenzyl)-1H-imidazole-5-yl]ethyl]-L-leucine ...
MW:     393.864560 g/mol MF: C19H24ClN3O4
IUPAC name: (2S)-2-[[(1S)-1-carboxy-2-[3-[(4-chlorophenyl)methyl]imidazo...
Create Date: 2008-05-08
CID: 24776241

3865. Amino dicarboxylate analogue, 8; BDBM21481; N-[(S)-1-Carboxy-2-[1-(4-nitrobenzyl)-1H-imidazole-5-yl]ethyl]-L-leucine ...
MW:     404.417060 g/mol MF: C19H24N4O6
IUPAC name: (2S)-2-[[(1S)-1-carboxy-2-[3-[(4-nitrophenyl)methyl]imidazol...
Create Date: 2008-05-08
CID: 24776240

3866. Amino dicarboxylate analogue, 6; BDBM21480; (2S)-2-{[(1S)-1-carboxy-2-[1-(cyclohexylmethyl)-1H-imidazol-5-yl]ethyl]amino}-4-methylpentanoic acid
MW:     365.467140 g/mol MF: C19H31N3O4
IUPAC name: (2S)-2-[[(1S)-1-carboxy-2-[3-(cyclohexylmethyl)imidazol-4-yl...
Create Date: 2008-05-08
CID: 24776239

3867. Amino dicarboxylate analogue, 5; BDBM21479; N-[(S)-1-Carboxy-2-(1-benzyl-1H-imidazole-5-yl)ethyl]-L-phenylalanine ...
MW:     393.435720 g/mol MF: C22H23N3O4
IUPAC name: (2S)-2-[[(1S)-2-(3-benzylimidazol-4-yl)-1-carboxyethyl]amino...
Create Date: 2008-05-08
CID: 24776238

3868. Amino dicarboxylate analogue, 4; BDBM21478; (2S)-2-{[(1S)-2-(1-benzyl-1H-imidazol-5-yl)-1-carboxyethyl]amino}butanoic acid ...
MW:     331.366340 g/mol MF: C17H21N3O4
IUPAC name: (2S)-2-[[(1S)-2-(3-benzylimidazol-4-yl)-1-carboxyethyl]amino...
Create Date: 2008-05-08
CID: 24776237

3869. Morpholino-ethyl analogue, 43; CHEMBL409537; BDBM21322 ...
MW:     447.590820 g/mol MF: C23H33N3O4S
IUPAC name: N-[1-(2-morpholin-4-ylethyl)-3-(2,2,3,3-tetramethylcycloprop...
Create Date: 2008-04-23
CID: 24768504

3870. Morpholino-ethyl analogue, 42; CHEMBL408174; BDBM21321 ...
MW:     411.537120 g/mol MF: C24H33N3O3
IUPAC name: N-[1-(2-morpholin-4-ylethyl)-3-(2,2,3,3-tetramethylcycloprop...
Create Date: 2008-04-23
CID: 24768503

3871. Morpholino-ethyl analogue, 37; CHEMBL406918; SCHEMBL2078989 ...
MW:     460.607740 g/mol MF: C29H36N2O3
IUPAC name: [1-(2-morpholin-4-ylethyl)-5-phenylmethoxyindol-3-yl]-(2,2,3...
Create Date: 2008-04-23
CID: 24768502

3872. Morpholino-ethyl analogue, 35; CHEMBL409231; SCHEMBL2077571 ...
MW:     384.511780 g/mol MF: C23H32N2O3
IUPAC name: [5-methoxy-1-(2-morpholin-4-ylethyl)indol-3-yl]-(2,2,3,3-tet...
Create Date: 2008-04-23
CID: 24768501

3873. Morpholino-ethyl analogue, 33; CHEMBL411673; SCHEMBL2075393 ...
MW:     370.485200 g/mol MF: C22H30N2O3
IUPAC name: [5-hydroxy-1-(2-morpholin-4-ylethyl)indol-3-yl]-(2,2,3,3-tet...
Create Date: 2008-04-23
CID: 24768500

3874. 4-t-butylbenzyl analogue, 58; CHEMBL254408; SCHEMBL5673525 ...
MW:     548.709643 g/mol MF: C29H41FN2O5S
IUPAC name: [(2S)-2-[(4-tert-butylphenyl)methyl]-3-[[(2R)-2-[3-fluoro-4-...
Create Date: 2008-03-24
CID: 24755458

3875. 4-t-butylbenzyl analogue, 71; CHEMBL428063; SCHEMBL5673521 ...
MW:     548.709643 g/mol MF: C29H41FN2O5S
IUPAC name: [(2R)-2-[(4-tert-butylphenyl)methyl]-3-[[(2R)-2-[3-fluoro-4-...
Create Date: 2008-03-24
CID: 24754607

3876. 4-t-butylbenzyl analogue, 60; CHEMBL254614; SCHEMBL5674724 ...
MW:     565.164240 g/mol MF: C29H41ClN2O5S
IUPAC name: [(2S)-2-[(4-tert-butylphenyl)methyl]-3-[[(2S)-2-[3-chloro-4-...
Create Date: 2008-03-24
CID: 24754529

3877. 4-t-butylbenzyl analogue, 59; CHEMBL254409; SCHEMBL5673735 ...
MW:     548.709643 g/mol MF: C29H41FN2O5S
IUPAC name: [(2S)-2-[(4-tert-butylphenyl)methyl]-3-[[(2S)-2-[3-fluoro-4-...
Create Date: 2008-03-24
CID: 24754528

3878. CHEMBL254665; cyclopropyl amide analogue, 28; SCHEMBL5676793 ...
MW:     544.702700 g/mol MF: C29H40N2O6S
IUPAC name: [2-[(3,4-dimethylphenyl)methyl]-3-[[1-[4-(methanesulfonamido...
Create Date: 2008-03-24
CID: 24754325

3879. CHEMBL254664; cyclopropyl amide analogue, 27; SCHEMBL5947653 ...
MW:     532.667183 g/mol MF: C28H37FN2O5S
IUPAC name: [2-[(3,4-dimethylphenyl)methyl]-3-[[1-[3-fluoro-4-(methanesu...
Create Date: 2008-03-24
CID: 24754324

3880. CHEMBL254663; cyclopropyl amide analogue, 26; SCHEMBL5947409 ...
MW:     514.676720 g/mol MF: C28H38N2O5S
IUPAC name: [2-[(3,4-dimethylphenyl)methyl]-3-[[1-[4-(methanesulfonamido...
Create Date: 2008-03-24
CID: 24754323

3881. 4-t-butylbenzyl analogue, 72; CHEMBL254615; SCHEMBL5673740 ...
MW:     548.709643 g/mol MF: C29H41FN2O5S
IUPAC name: [(2R)-2-[(4-tert-butylphenyl)methyl]-3-[[(2S)-2-[3-fluoro-4-...
Create Date: 2008-03-03
CID: 24742043

3882. CHEMBL377285; SCHEMBL2155423; BDBM19544 ...
MW:     480.524690 g/mol MF: C27H27F3N4O
IUPAC name: (2S)-N-(cyanomethyl)-4-methyl-2-[[(1S)-2,2,2-trifluoro-1-[4-...
Create Date: 2008-01-19
CID: 23648309

3883. CHEMBL382820; SCHEMBL2156911; BDBM19543 ...
MW:     557.627010 g/mol MF: C29H30F3N3O3S
IUPAC name: (2S)-N-(cyanomethyl)-4-methyl-2-[[(1S)-2,2,2-trifluoro-1-[4-...
Create Date: 2008-01-19
CID: 23648308

3884. BDBM19542; trifluoroethylamine analogue, 32; (2S)-2-{[(1S)-1-[4-(1H-1,3-benzodiazol-4-yl)phenyl]-2,2,2-trifluoroethyl]amino}-N-(cyanomethyl)-4-methylpentanamide
MW:     443.464770 g/mol MF: C23H24F3N5O
IUPAC name: (2S)-2-[[(1S)-1-[4-(1H-benzimidazol-4-yl)phenyl]-2,2,2-trifl...
Create Date: 2008-01-19
CID: 23648307

3885. CHEMBL382038; SCHEMBL2155453; BDBM19540 ...
MW:     409.405490 g/mol MF: C19H22F3N5O2
IUPAC name: (2S)-N-(cyanomethyl)-4-methyl-2-[[(1S)-2,2,2-trifluoro-1-[4-...
Create Date: 2008-01-19
CID: 23648306

3886. CHEMBL426493; SCHEMBL2156594; BDBM19536 ...
MW:     431.450770 g/mol MF: C23H24F3N3O2
IUPAC name: (2S)-2-[[(1S)-1-(4-benzoylphenyl)-2,2,2-trifluoroethyl]amino...
Create Date: 2008-01-19
CID: 23648305

3887. CHEMBL206913; SCHEMBL2155693; BDBM19535 ...
MW:     419.440070 g/mol MF: C22H24F3N3O2
IUPAC name: (2S)-N-(cyanomethyl)-4-methyl-2-[[(1S)-2,2,2-trifluoro-1-(4-...
Create Date: 2008-01-19
CID: 23648304

3888. CHEMBL206912; SCHEMBL2156356; BDBM19534 ...
MW:     481.531050 g/mol MF: C23H26F3N3O3S
IUPAC name: (2S)-N-(cyanomethyl)-4-methyl-2-[[(1S)-2,2,2-trifluoro-1-[4-...
Create Date: 2008-01-19
CID: 23648303

3889. CHEMBL203944; SCHEMBL2155129; BDBM19530 ...
MW:     433.466650 g/mol MF: C23H26F3N3O2
IUPAC name: (2S)-N-(cyanomethyl)-4-methyl-2-[[(1S)-2,2,2-trifluoro-1-[4-...
Create Date: 2008-01-19
CID: 23648302

3890. CHEMBL208278; SCHEMBL2157020; BDBM19529 ...
MW:     417.467250 g/mol MF: C23H26F3N3O
IUPAC name: (2S)-N-(cyanomethyl)-4-methyl-2-[[(1S)-2,2,2-trifluoro-1-[4-...
Create Date: 2008-01-19
CID: 23648301

3891. CHEMBL204792; SCHEMBL2156540; BDBM19523 ...
MW:     403.440670 g/mol MF: C22H24F3N3O
IUPAC name: (2S)-N-(cyanomethyl)-4-methyl-2-[[(1S)-2,2,2-trifluoro-1-(4-...
Create Date: 2008-01-19
CID: 23648300

3892. CHEMBL204276; BDBM19521; trifluoroethylamine analogue, 10 ...
MW:     327.344710 g/mol MF: C16H20F3N3O
IUPAC name: (2S)-N-(cyanomethyl)-4-methyl-2-[[(1S)-2,2,2-trifluoro-1-phe...
Create Date: 2008-01-19
CID: 23648299

3893. CHEMBL206169; trifluoroethylamine analogue, 9; BDBM19520 ...
MW:     307.355070 g/mol MF: C14H24F3N3O
IUPAC name: (2S)-N-(cyanomethyl)-4-methyl-2-[[(2S)-1,1,1-trifluorohexan-...
Create Date: 2008-01-19
CID: 23648298

3894. CHEMBL206166; trifluoroethylamine analogue, 8; BDBM19519 ...
MW:     251.248750 g/mol MF: C10H16F3N3O
IUPAC name: (2S)-N-(cyanomethyl)-4-methyl-2-(2,2,2-trifluoroethylamino)p...
Create Date: 2008-01-19
CID: 23648297

3895. Monocyclic thiophene analog 35; CHEMBL214912; SCHEMBL3905952 ...
MW:     510.441120 g/mol MF: C23H28BrNO5S
IUPAC name: 4-bromo-3-(carboxymethoxy)-5-[4-[(3,3,5,5-tetramethylcyclohe...
Create Date: 2008-01-19
CID: 23646680

3896. Monocyclic thiophene analog 34; CHEMBL386616; SCHEMBL3907186 ...
MW:     457.295680 g/mol MF: C17H17BrN2O6S
IUPAC name: 4-bromo-3-(carboxymethoxy)-5-[4-(propan-2-ylcarbamoylamino)p...
Create Date: 2008-01-19
CID: 23646679

3897. Monocyclic thiophene analog 33; CHEMBL385276; SCHEMBL3908180 ...
MW:     430.227280 g/mol MF: C15H12BrNO7S
IUPAC name: 4-bromo-3-(carboxymethoxy)-5-[4-(methoxycarbonylamino)phenyl...
Create Date: 2008-01-19
CID: 23646678

3898. Monocyclic thiophene analog 32; CHEMBL438089; SCHEMBL3905947 ...
MW:     594.375510 g/mol MF: C21H15BrF3NO7S2
IUPAC name: 4-bromo-3-(carboxymethoxy)-5-[4-[methyl-[4-(trifluoromethyl)...
Create Date: 2008-01-19
CID: 23646677

3899. Monocyclic thiophene analog 31; CHEMBL383882; SCHEMBL3909808 ...
MW:     580.348930 g/mol MF: C20H13BrF3NO7S2
IUPAC name: 4-bromo-3-(carboxymethoxy)-5-[4-[[4-(trifluoromethyl)phenyl]...
Create Date: 2008-01-19
CID: 23646676

3900. Monocyclic thiophene analog 30; CHEMBL214794; SCHEMBL3905651 ...
MW:     450.281580 g/mol MF: C14H12BrNO7S2
IUPAC name: 4-bromo-3-(carboxymethoxy)-5-[4-(methanesulfonamido)phenyl]t...
Create Date: 2008-01-19
CID: 23646675

3901. Monocyclic thiophene analog 29; CHEMBL212285; SCHEMBL3905215 ...
MW:     476.297260 g/mol MF: C20H14BrNO6S
IUPAC name: 4-bromo-3-(carboxymethoxy)-5-[4-(phenylcarbamoyl)phenyl]thio...
Create Date: 2008-01-19
CID: 23646674

3902. Monocyclic thiophene analog 28; CHEMBL212232; SCHEMBL3907093 ...
MW:     476.297260 g/mol MF: C20H14BrNO6S
IUPAC name: 5-(4-benzamidophenyl)-4-bromo-3-(carboxymethoxy)thiophene-2-...
Create Date: 2008-01-19
CID: 23646673

3903. CHEMBL214378; Monocyclic thiophene analog 27; SCHEMBL3908592 ...
MW:     477.285320 g/mol MF: C19H13BrN2O6S
IUPAC name: 4-bromo-3-(carboxymethoxy)-5-[4-(pyridine-3-carbonylamino)ph...
Create Date: 2008-01-19
CID: 23646672

3904. Monocyclic thiophene analog 26; CHEMBL387242; SCHEMBL3907098 ...
MW:     466.259380 g/mol MF: C18H12BrNO7S
IUPAC name: 4-bromo-3-(carboxymethoxy)-5-[4-(furan-2-carbonylamino)pheny...
Create Date: 2008-01-19
CID: 23646671

3905. Monocyclic thiophene analog 25; CHEMBL214911; SCHEMBL3906951 ...
MW:     414.227880 g/mol MF: C15H12BrNO6S
IUPAC name: 5-(4-acetamidophenyl)-4-bromo-3-(carboxymethoxy)thiophene-2-...
Create Date: 2008-01-19
CID: 23646670

3906. Monocyclic thiophene analog 24; CHEMBL379196; SCHEMBL3909188 ...
MW:     400.244360 g/mol MF: C15H14BrNO5S
IUPAC name: 4-bromo-3-(carboxymethoxy)-5-[4-(dimethylamino)phenyl]thioph...
Create Date: 2008-01-19
CID: 23646669

3907. Monocyclic thiophene analog 23; CHEMBL212335; SCHEMBL3907204 ...
MW:     372.191200 g/mol MF: C13H10BrNO5S
IUPAC name: 5-(4-aminophenyl)-4-bromo-3-(carboxymethoxy)thiophene-2-carb...
Create Date: 2008-01-19
CID: 23646668

3908. Monocyclic thiophene analog 20; CHEMBL383967; BDBM14253 ...
MW:     396.212600 g/mol MF: C15H10BrNO5S
IUPAC name: 4-bromo-3-(carboxymethoxy)-5-(1H-indol-6-yl)thiophene-2-carb...
Create Date: 2008-01-19
CID: 23646667

3909. Monocyclic thiophene analog 18; CHEMBL385896; SCHEMBL3907072 ...
MW:     387.202540 g/mol MF: C14H11BrO6S
IUPAC name: 4-bromo-3-(carboxymethoxy)-5-(4-methoxyphenyl)thiophene-2-ca...
Create Date: 2008-01-19
CID: 23646666

3910. Monocyclic thiophene analog 15; CHEMBL215243; BDBM14249 ...
MW:     397.197360 g/mol MF: C15H9BrO6S
IUPAC name: 5-(1-benzofuran-6-yl)-4-bromo-3-(carboxymethoxy)thiophene-2-...
Create Date: 2008-01-19
CID: 23646665

3911. Monocyclic thiophene analog 14; CHEMBL215242; SCHEMBL3905733 ...
MW:     407.235240 g/mol MF: C17H11BrO5S
IUPAC name: 4-bromo-3-(carboxymethoxy)-5-naphthalen-2-ylthiophene-2-carb...
Create Date: 2008-01-19
CID: 23646664

3912. Monocyclic thiophene analog 13; CHEMBL215656; SCHEMBL3910596 ...
MW:     358.164620 g/mol MF: C12H8BrNO5S
IUPAC name: 4-bromo-3-(carboxymethoxy)-5-pyridin-3-ylthiophene-2-carboxy...
Create Date: 2008-01-19
CID: 23646663

3913. Monocyclic thiophene analog 12; CHEMBL373883; SCHEMBL3906983 ...
MW:     363.204280 g/mol MF: C11H7BrO5S2
IUPAC name: 4-bromo-3-(carboxymethoxy)-5-thiophen-3-ylthiophene-2-carbox...
Create Date: 2008-01-19
CID: 23646662

3914. CHEMBL384653; SCHEMBL1604492; 2-(S)-Phenethylamine analog 8 ...
MW:     294.387563 g/mol MF: C15H19FN2OS
IUPAC name: 2-[[(1S)-1-(2-fluorophenyl)ethyl]amino]-5-methyl-5-propan-2-...
Create Date: 2008-01-19
CID: 23646478

3915. sulfotyrosyl tripeptide analog 9; BDBM13614; 2-(carboxymethoxy)-5-[(2S)-2-(pentylcarbamoyl)-2-[(2S)-3-phenyl-2-[1-(5-sulfanyl-1H-1,2,3-triazol-1-yl)acetamido]propanamido]ethyl]benzoic acid
MW:     640.707240 g/mol MF: C30H36N6O8S
IUPAC name: 2-(carboxymethoxy)-5-[(2S)-3-oxo-3-(pentylamino)-2-[[(2S)-3-...
Create Date: 2008-01-19
CID: 23646471

3916. SCHEMBL6572497; sulfotyrosyl tripeptide analog 5; BDBM13610 ...
MW:     452.455020 g/mol MF: C21H28N2O9
IUPAC name: 2-(carboxymethoxy)-5-[(2S)-2-(3-carboxypropanoylamino)-3-oxo...
Create Date: 2008-01-19
CID: 23646470

3917. alpha-ketothiazole analogue 16; CHEMBL384603; BDBM12956 ...
MW:     669.665980 g/mol MF: C29H42Cl2N8O4S
IUPAC name: (2S)-N-[(2S)-5-(diaminomethylideneamino)-1-oxo-1-(1,3-thiazo...
Create Date: 2008-01-19
CID: 23646329

3918. CHEMBL379397; BDBM12704; BMS-740808 Analogue 12d ...
MW:     552.598763 g/mol MF: C31H29FN6O3
IUPAC name: 1-(3-amino-1,2-benzoxazol-5-yl)-6-[2-fluoro-4-[2-[[(3R)-3-hy...
Create Date: 2008-01-19
CID: 23646165

3919. CHEMBL380405; BDBM12703; BMS-740808 Analogue 12c ...
MW:     534.608300 g/mol MF: C31H30N6O3
IUPAC name: 1-(3-amino-1,2-benzoxazol-5-yl)-6-[4-[2-[[(3R)-3-hydroxypyrr...
Create Date: 2008-01-19
CID: 23646164

3920. BMS-740808 Analogue 7c; CHEMBL263767; BDBM12700 ...
MW:     606.570153 g/mol MF: C31H26F4N6O3
IUPAC name: 1-(3-amino-1,2-benzoxazol-5-yl)-6-[2-fluoro-4-[2-[[(3R)-3-hy...
Create Date: 2008-01-19
CID: 23646163

3921. BMS-740808 Analogue 7b; CHEMBL402881; BDBM12699 ...
MW:     590.570753 g/mol MF: C31H26F4N6O2
IUPAC name: 1-(3-amino-1,2-benzoxazol-5-yl)-6-[2-fluoro-4-[2-(pyrrolidin...
Create Date: 2008-01-19
CID: 23646162

3922. BMS-740808 Analogue 6k; CHEMBL265087; BDBM12698 ...
MW:     601.621510 g/mol MF: C32H30F3N7O2
IUPAC name: 1-(3-amino-1,2-benzoxazol-5-yl)-6-[4-[2-[(4-methylpiperazin-...
Create Date: 2008-01-19
CID: 23646161

3923. BMS-740808 Analogue 6j; CHEMBL212202; BDBM12697 ...
MW:     587.594930 g/mol MF: C31H28F3N7O2
IUPAC name: 1-(3-amino-1,2-benzoxazol-5-yl)-6-[4-[2-(piperazin-1-ylmethy...
Create Date: 2008-01-19
CID: 23646160

3924. BMS-740808 Analogue 6h; CHEMBL213888; BDBM12695 ...
MW:     602.606270 g/mol MF: C32H29F3N6O3
IUPAC name: 1-(3-amino-1,2-benzoxazol-5-yl)-6-[4-[2-[(4-hydroxypiperidin...
Create Date: 2008-01-19
CID: 23646159

3925. BMS-740808 Analogue 6g; CHEMBL378222; SCHEMBL8360892 ...
MW:     588.579690 g/mol MF: C31H27F3N6O3
IUPAC name: 1-(3-amino-1,2-benzoxazol-5-yl)-6-[4-[2-[[(3S)-3-hydroxypyrr...
Create Date: 2008-01-19
CID: 23646158

3926. BMS-740808 Analogue 6d; CHEMBL209376; BDBM12691 ...
MW:     532.516430 g/mol MF: C28H23F3N6O2
IUPAC name: 1-(3-amino-1,2-benzoxazol-5-yl)-6-[4-[2-(methylaminomethyl)p...
Create Date: 2008-01-19
CID: 23646157

3927. BMS-740808 Analogue 6c; CHEMBL213252; BDBM12690 ...
MW:     560.569590 g/mol MF: C30H27F3N6O2
IUPAC name: 1-(3-amino-1,2-benzoxazol-5-yl)-6-[4-[2-[[ethyl(methyl)amino...
Create Date: 2008-01-19
CID: 23646156

3928. BMS-740808 Analogue 6b; CHEMBL386294; BDBM12689 ...
MW:     574.596170 g/mol MF: C31H29F3N6O2
IUPAC name: 1-(3-amino-1,2-benzoxazol-5-yl)-6-[4-[2-(diethylaminomethyl)...
Create Date: 2008-01-19
CID: 23646155

3929. BMS-740808 Analogue 7a; CHEMBL436791; BDBM12682 ...
MW:     564.533473 g/mol MF: C29H24F4N6O2
IUPAC name: 1-(3-amino-1,2-benzoxazol-5-yl)-6-[4-[2-[(dimethylamino)meth...
Create Date: 2008-01-19
CID: 23646154

3930. CHEMBL414599; BDBM12299; SCH 503034 Analogue 58 ...
MW:     504.619000 g/mol MF: C26H40N4O6
IUPAC name: tert-butyl N-[(1S)-2-[(1R,2S,5S)-2-[(4-amino-1-cyclopropyl-3...
Create Date: 2008-01-19
CID: 23646045

3931. SCHEMBL10139733; BDBM12279; SCH 503034 Analogue 38 ...
MW:     522.677340 g/mol MF: C27H46N4O6
IUPAC name: tert-butyl N-[(2S)-1-[(1R,2S,5S)-2-[[1-(dimethylamino)-1,2-d...
Create Date: 2008-01-19
CID: 23646044

3932. SCHEMBL10139731; BDBM12277; SCH 503034 Analogue 36 ...
MW:     508.650760 g/mol MF: C26H44N4O6
IUPAC name: tert-butyl N-[(2S)-1-[(1R,2S,5S)-6,6-dimethyl-2-[[1-(methyla...
Create Date: 2008-01-19
CID: 23646043

3933. CHEMBL235265; BDBM18991; Pyrazolopyridinone analogue, 13f ...
MW:     537.608940 g/mol MF: C31H31N5O4
IUPAC name: 6-[4-[2-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]phenyl]phenyl...
Create Date: 2008-01-07
CID: 23636371

3934. CHEMBL237441; Pyrazolopyridinone analogue, 12; BDBM18990 ...
MW:     538.593700 g/mol MF: C31H30N4O5
IUPAC name: 6-[4-[2-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]phenyl]phenyl...
Create Date: 2008-01-07
CID: 23636368

3935. CHEMBL237242; BDBM18989; Pyrazolopyridinone analogue, 11b ...
MW:     566.646860 g/mol MF: C33H34N4O5
IUPAC name: ethyl 6-[4-[2-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]phenyl]...
Create Date: 2008-01-07
CID: 23636367

3936. CHEMBL264106; BDBM18988; Pyrazolopyridinone analogue, 11a ...
MW:     572.674580 g/mol MF: C31H32N4O5S
IUPAC name: 6-[4-[2-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]phenyl]phenyl...
Create Date: 2008-01-07
CID: 23636240

3937. CHEMBL395371; BDBM19004; Pyrazolopyridinone analogue, 33c ...
MW:     575.660220 g/mol MF: C33H33N7O3
IUPAC name: 6-[4-[2-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]phenyl]phenyl...
Create Date: 2008-01-07
CID: 23635750

3938. CHEMBL439214; BDBM19002; Pyrazolopyridinone analogue, 33a ...
MW:     575.660220 g/mol MF: C33H33N7O3
IUPAC name: 6-[4-[2-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]phenyl]phenyl...
Create Date: 2008-01-07
CID: 23635626

3939. CHEMBL235268; BDBM18992; Pyrazolopyridinone analogue, 15a ...
MW:     551.635520 g/mol MF: C32H33N5O4
IUPAC name: 6-[4-[2-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]phenyl]phenyl...
Create Date: 2008-01-07
CID: 23635503

3940. CHEMBL395373; BDBM19006; Pyrazolopyridinone analogue, 33e ...
MW:     576.648280 g/mol MF: C32H32N8O3
IUPAC name: 6-[4-[2-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]phenyl]phenyl...
Create Date: 2008-01-07
CID: 23635260

3941. CHEMBL395372; BDBM19005; Pyrazolopyridinone analogue, 33d ...
MW:     576.648280 g/mol MF: C32H32N8O3
IUPAC name: 6-[4-[2-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]phenyl]phenyl...
Create Date: 2008-01-07
CID: 23635133

3942. CHEMBL395142; BDBM19003; Pyrazolopyridinone analogue, 33b ...
MW:     575.660220 g/mol MF: C33H33N7O3
IUPAC name: 6-[4-[2-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]phenyl]phenyl...
Create Date: 2008-01-07
CID: 23635132

3943. CHEMBL396088; Pyrazolopyridinone analogue, 28; BDBM19001 ...
MW:     562.621700 g/mol MF: C31H30N8O3
IUPAC name: 6-[4-[2-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]phenyl]phenyl...
Create Date: 2008-01-07
CID: 23634881

3944. Pyrazolopyridinone analogue, 27; BDBM19000; 6-[4-(2-{[(3R)-3-hydroxypyrrolidin-1-yl]methyl}phenyl)phenyl]-1-(4-methoxyphenyl)-3-(1-methyl-1H-1,2,3,4-tetrazol-5-yl)-1H,4H,5H,6H,7H-pyrazolo[3,4-c]pyridin-7-one
MW:     576.648280 g/mol MF: C32H32N8O3
IUPAC name: 6-[4-[2-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]phenyl]phenyl...
Create Date: 2008-01-07
CID: 23634880

3945. CHEMBL235064; Pyrazolopyridinone analogue, 25; BDBM18999 ...
MW:     537.652000 g/mol MF: C32H35N5O3
IUPAC name: 3-(dimethylamino)-6-[4-[2-[[(3R)-3-hydroxypyrrolidin-1-yl]me...
Create Date: 2008-01-07
CID: 23634878

3946. CHEMBL399822; Pyrazolopyridinone analogue, 24; BDBM18998 ...
MW:     523.625420 g/mol MF: C31H33N5O3
IUPAC name: 6-[4-[2-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]phenyl]phenyl...
Create Date: 2008-01-07
CID: 23634877

3947. CHEMBL391787; Pyrazolopyridinone analogue, 23; BDBM18997
MW:     623.741240 g/mol MF: C36H41N5O5
IUPAC name: tert-butyl N-[6-[4-[2-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl...
Create Date: 2008-01-07
CID: 23634758

3948. CHEMBL236752; Pyrazolopyridinone analogue, 22; BDBM18996 ...
MW:     509.598840 g/mol MF: C30H31N5O3
IUPAC name: 3-amino-6-[4-[2-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]pheny...
Create Date: 2008-01-07
CID: 23634757

3949. CHEMBL238301; Pyrazolopyridinone analogue, 21; BDBM18995
MW:     609.714660 g/mol MF: C35H39N5O5
IUPAC name: tert-butyl N-[6-[4-[2-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl...
Create Date: 2008-01-07
CID: 23634756

3950. CHEMBL393393; Pyrazolopyridinone analogue, 18; BDBM18994 ...
MW:     519.593660 g/mol MF: C31H29N5O3
IUPAC name: 6-[4-[2-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]phenyl]phenyl...
Create Date: 2008-01-07
CID: 23634640

3951. CHEMBL235492; BDBM18993; Pyrazolopyridinone analogue, 15b ...
MW:     565.662100 g/mol MF: C33H35N5O4
IUPAC name: 6-[4-[2-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]phenyl]phenyl...
Create Date: 2008-01-07
CID: 23634638

3952. CHEMBL262372; BDBM12300; SCH 503034 Analogue 59 ...
MW:     518.645580 g/mol MF: C27H42N4O6
IUPAC name: tert-butyl N-[(1S)-2-[(1R,2S,5S)-2-[(4-amino-1-cyclobutyl-3,...
Create Date: 2007-12-17
CID: 23624978

3953. CHEMBL319556; Dihydro-quinazolinone analog, 9; BDBM17060 ...
MW:     488.356546 g/mol MF: C25H21Cl2F2N3O
IUPAC name: 1-(2,6-dichlorophenyl)-5-(2,4-difluorophenyl)-7-piperidin-4-...
Create Date: 2007-12-06
CID: 23532567

3954. CHEMBL85869; SCHEMBL7341515; CGS 27023A Analog 44 ...
MW:     401.436260 g/mol MF: C19H19N3O5S
IUPAC name: N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(quinolin-2-ylmethyl)...
Create Date: 2007-12-05
CID: 22907131

3955. 4-amino-N-[4-(benzyloxy)phenyl]butanamide; CHEMBL478718; Modified amino acid analog, 7a ...
MW:     284.352900 g/mol MF: C17H20N2O2
IUPAC name: 4-amino-N-(4-phenylmethoxyphenyl)butanamide
Create Date: 2007-12-05
CID: 22692237

3956. CHEMBL96632; SCHEMBL6669680; Dihydro-quinazolinone analog, 5 ...
MW:     433.715000 g/mol MF: C21H15Cl3N2O2
IUPAC name: 5-(2-chlorophenyl)-1-(2,6-dichlorophenyl)-7-methoxy-3,4-dihy...
Create Date: 2007-12-05
CID: 22648169

3957. CHEMBL94556; methyl 5-(2-chlorophenyl)-1-(2,6-dichlorophenyl)-2-oxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate; SCHEMBL6647374 ...
MW:     461.725100 g/mol MF: C22H15Cl3N2O3
IUPAC name: methyl 5-(2-chlorophenyl)-1-(2,6-dichlorophenyl)-2-oxo-3,4-d...
Create Date: 2007-12-05
CID: 22648138

3958. CHEMBL425422; SCHEMBL6666639; Dihydro-quinazolinone analog, 6 ...
MW:     418.703660 g/mol MF: C20H14Cl3N3O
IUPAC name: 7-amino-5-(2-chlorophenyl)-1-(2,6-dichlorophenyl)-3,4-dihydr...
Create Date: 2007-12-05
CID: 22647927

3959. CHEMBL210110; SCHEMBL6668781; Dihydro-quinazolinone analog, 8 ...
MW:     419.688420 g/mol MF: C20H13Cl3N2O2
IUPAC name: 5-(2-chlorophenyl)-1-(2,6-dichlorophenyl)-7-hydroxy-3,4-dihy...
Create Date: 2007-12-05
CID: 22647873

3960. bicyclic pyrazole scaffolds; CHEMBL210175; BDBM12683 ...
MW:     560.569590 g/mol MF: C30H27F3N6O2
IUPAC name: 1-(3-amino-1,2-benzoxazol-5-yl)-7-[4-[2-[(dimethylamino)meth...
Create Date: 2007-12-05
CID: 22087007

3961. CHEMBL209916; BDBM12684; BMS-740808 Analogue 16b ...
MW:     578.560053 g/mol MF: C30H26F4N6O2
IUPAC name: 1-(3-amino-1,2-benzoxazol-5-yl)-7-[4-[2-[(dimethylamino)meth...
Create Date: 2007-12-05
CID: 22087006

3962. CHEMBL379588; BDBM12702; BMS-740808 Analogue 12b ...
MW:     518.608900 g/mol MF: C31H30N6O2
IUPAC name: 1-(3-amino-1,2-benzoxazol-5-yl)-3-methyl-6-[4-[2-(pyrrolidin...
Create Date: 2007-12-05
CID: 22086988

3963. BMS-740808 Analogue 6e; CHEMBL378092; BDBM12692 ...
MW:     572.580290 g/mol MF: C31H27F3N6O2
IUPAC name: 1-(3-amino-1,2-benzoxazol-5-yl)-6-[4-[2-(pyrrolidin-1-ylmeth...
Create Date: 2007-12-05
CID: 22086982

3964. BMS-740808 Analogue 6i; CHEMBL428982; BDBM12696 ...
MW:     588.579690 g/mol MF: C31H27F3N6O3
IUPAC name: 1-(3-amino-1,2-benzoxazol-5-yl)-6-[4-[2-(morpholin-4-ylmethy...
Create Date: 2007-12-05
CID: 22086981

3965. CHEMBL212770; BDBM12687; BMS-740808 Analogue 18 ...
MW:     547.531070 g/mol MF: C28H24F3N7O2
IUPAC name: 1-(3-amino-1,2-benzoxazol-5-yl)-6-[4-[2-[(dimethylamino)meth...
Create Date: 2007-12-05
CID: 22086975

3966. CHEMBL385679; BDBM12701; BMS-740808 Analogue 12a ...
MW:     492.571620 g/mol MF: C29H28N6O2
IUPAC name: 1-(3-amino-1,2-benzoxazol-5-yl)-6-[4-[2-[(dimethylamino)meth...
Create Date: 2007-12-05
CID: 22086973

3967. Benzimidazole urea analogue, 5; CHEMBL471319; SCHEMBL14097673 ...
MW:     371.368923 g/mol MF: C17H18FN7O2
IUPAC name: N-cyclopropyl-1-[2-(ethylcarbamoylamino)-6-fluoro-1H-benzimi...
Create Date: 2007-12-05
CID: 21366124

3968. CHEMBL487832; SCHEMBL14097629; BDBM24612 ...
MW:     387.434440 g/mol MF: C22H21N5O2
IUPAC name: 1-ethyl-3-(4-phenylmethoxy-6-pyridin-3-yl-1H-benzimidazol-2-...
Create Date: 2007-12-05
CID: 21366049

3969. Benzimidazole urea analogue, 7; CHEMBL472010; SCHEMBL14097576 ...
MW:     295.339080 g/mol MF: C16H17N5O
IUPAC name: 1-ethyl-3-(6-methyl-5-pyridin-3-yl-1H-benzimidazol-2-yl)urea
Create Date: 2007-12-05
CID: 21365990

3970. Benzimidazole urea analogue, 8; CHEMBL486645; SCHEMBL14097413 ...
MW:     311.338480 g/mol MF: C16H17N5O2
IUPAC name: 1-ethyl-3-(5-methoxy-6-pyridin-3-yl-1H-benzimidazol-2-yl)ure...
Create Date: 2007-12-05
CID: 21365988

3971. Benzimidazole urea analogue, 6; CHEMBL472009; SCHEMBL14097438 ...
MW:     299.302963 g/mol MF: C15H14FN5O
IUPAC name: 1-ethyl-3-(6-fluoro-5-pyridin-3-yl-1H-benzimidazol-2-yl)urea
Create Date: 2007-12-05
CID: 21365985

3972. Benzimidazole urea analogue, 9; CHEMBL486646; SCHEMBL14097646 ...
MW:     364.444160 g/mol MF: C20H24N6O
IUPAC name: 1-ethyl-3-(5-piperidin-1-yl-6-pyridin-3-yl-1H-benzimidazol-2...
Create Date: 2007-12-05
CID: 21365983

3973. Benzimidazole urea analogue, 2; CHEMBL472524; SCHEMBL14097547 ...
MW:     281.312500 g/mol MF: C15H15N5O
IUPAC name: 1-ethyl-3-(6-pyridin-3-yl-1H-benzimidazol-2-yl)urea
Create Date: 2007-12-05
CID: 21365956

3974. PSTQ Analog, 3{9,31}; BDBM93382; MolPort-007-662-100 ...
MW:     457.547420 g/mol MF: C25H23N5O2S
IUPAC name: 3-(3,4-dimethylphenyl)sulfonyl-N-(2-ethylphenyl)triazolo[1,5...
Create Date: 2007-12-05
CID: 20878585

3975. 3-[(4-chlorophenyl)sulfonyl]-N-(2-ethylphenyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine; PSTQ Analog, 3{6,31}; MolPort-007-662-079 ...
MW:     463.939320 g/mol MF: C23H18ClN5O2S
IUPAC name: 3-(4-chlorophenyl)sulfonyl-N-(2-ethylphenyl)triazolo[1,5-a]q...
Create Date: 2007-12-05
CID: 20878565

3976. PSTQ Analog, 3{10,4}; BDBM93360; MolPort-007-662-057 ...
MW:     423.531200 g/mol MF: C22H25N5O2S
IUPAC name: N-butan-2-yl-3-(2,4,6-trimethylphenyl)sulfonyltriazolo[1,5-a...
Create Date: 2007-12-05
CID: 20878544

3977. PSTQ Analog, 3{10,3}; BDBM93359; MolPort-020-178-584 ...
MW:     409.504620 g/mol MF: C21H23N5O2S
IUPAC name: N-propan-2-yl-3-(2,4,6-trimethylphenyl)sulfonyltriazolo[1,5-...
Create Date: 2007-12-05
CID: 20878543

3978. PSTQ Analog, 3{9,53}; BDBM93388; MolPort-007-662-000 ...
MW:     435.541900 g/mol MF: C23H25N5O2S
IUPAC name: 5-(azepan-1-yl)-3-(3,4-dimethylphenyl)sulfonyltriazolo[1,5-a...
Create Date: 2007-12-05
CID: 20878486

3979. PSTQ Analog, 3{9,21}; BDBM93373; AKOS001864249 ...
MW:     437.514720 g/mol MF: C22H23N5O3S
IUPAC name: 3-(3,4-dimethylphenyl)sulfonyl-N-(oxolan-2-ylmethyl)triazolo...
Create Date: 2007-12-05
CID: 20878484

3980. PSTQ Analog, 3{9,20}; BDBM93372; MolPort-007-661-986 ...
MW:     457.547420 g/mol MF: C25H23N5O2S
IUPAC name: 3-(3,4-dimethylphenyl)sulfonyl-N-(1-phenylethyl)triazolo[1,5...
Create Date: 2007-12-05
CID: 20878474

3981. PSTQ Analog, 3{2,13}; BDBM93367; MolPort-007-661-966 ...
MW:     463.939320 g/mol MF: C23H18ClN5O2S
IUPAC name: N-[(2-chlorophenyl)methyl]-3-(4-methylphenyl)sulfonyltriazol...
Create Date: 2007-12-05
CID: 20878458

3982. PSTQ Analog, 3{2,20}; BDBM93368; MolPort-007-661-962 ...
MW:     443.520840 g/mol MF: C24H21N5O2S
IUPAC name: 3-(4-methylphenyl)sulfonyl-N-(1-phenylethyl)triazolo[1,5-a]q...
Create Date: 2007-12-05
CID: 20878455

3983. PSTQ Analog, 3{2,12}; BDBM93366; MolPort-007-661-960 ...
MW:     429.494260 g/mol MF: C23H19N5O2S
IUPAC name: N-benzyl-3-(4-methylphenyl)sulfonyltriazolo[1,5-a]quinazolin...
Create Date: 2007-12-05
CID: 20878453

3984. PSTQ Analog, 3{1,49}; BDBM93399; MolPort-020-178-582 ...
MW:     407.488740 g/mol MF: C21H21N5O2S
IUPAC name: 3-(benzenesulfonyl)-5-(2-methylpiperidin-1-yl)triazolo[1,5-a...
Create Date: 2007-12-05
CID: 20878451

3985. PSTQ Analog, 3{1,26}; BDBM93393; MolPort-019-717-127 ...
MW:     407.488740 g/mol MF: C21H21N5O2S
IUPAC name: 3-(benzenesulfonyl)-N-cyclohexyltriazolo[1,5-a]quinazolin-5-...
Create Date: 2007-12-05
CID: 20878450

3986. PSTQ Analog, 3{1,44}; BDBM93386; MolPort-007-661-958 ...
MW:     443.520840 g/mol MF: C24H21N5O2S
IUPAC name: 3-(benzenesulfonyl)-N-benzyl-N-ethyltriazolo[1,5-a]quinazoli...
Create Date: 2007-12-05
CID: 20878448

3987. PSTQ Analog, 3{1,28}; BDBM93395; MolPort-020-178-581 ...
MW:     421.515320 g/mol MF: C22H23N5O2S
IUPAC name: 3-(benzenesulfonyl)-N-(4-methylcyclohexyl)triazolo[1,5-a]qui...
Create Date: 2007-12-05
CID: 20878447

3988. SCHEMBL8019253; PSTQ Analog, 3{1,21}; BDBM93363 ...
MW:     409.461560 g/mol MF: C20H19N5O3S
IUPAC name: 3-(benzenesulfonyl)-N-(oxolan-2-ylmethyl)triazolo[1,5-a]quin...
Create Date: 2007-12-05
CID: 20878441

3989. SCHEMBL8034714; PSTQ Analog, 3{1,13}; BDBM93362 ...
MW:     449.912740 g/mol MF: C22H16ClN5O2S
IUPAC name: 3-(benzenesulfonyl)-N-[(2-chlorophenyl)methyl]triazolo[1,5-a...
Create Date: 2007-12-05
CID: 20878435

3990. PSTQ Analog, 3{1,12}; BDBM93361; MolPort-007-661-945 ...
MW:     415.467680 g/mol MF: C22H17N5O2S
IUPAC name: 3-(benzenesulfonyl)-N-benzyltriazolo[1,5-a]quinazolin-5-amin...
Create Date: 2007-12-05
CID: 20878431

3991. CHEMBL209483; BDBM12685; BMS-740808 Analogue 17a ...
MW:     558.553710 g/mol MF: C30H25F3N6O2
IUPAC name: 1-(3-amino-1,2-benzoxazol-5-yl)-7-[4-[2-[(dimethylamino)meth...
Create Date: 2007-12-05
CID: 20760216

3992. CHEMBL377589; BDBM12686; BMS-740808 Analogue 17b ...
MW:     576.544173 g/mol MF: C30H24F4N6O2
IUPAC name: 1-(3-amino-1,2-benzoxazol-5-yl)-7-[4-[2-[(dimethylamino)meth...
Create Date: 2007-12-05
CID: 20760215

3993. CHEMBL468207; BDBM22194; GBR 12935 Analogue, 23 ...
MW:     450.520226 g/mol MF: C27H28F2N2O2
IUPAC name: 2-[4-[2-[bis(4-fluorophenyl)methoxy]ethyl]piperazin-1-yl]-1-...
Create Date: 2007-12-05
CID: 20443040

3994. CHEMBL511950; SCHEMBL10632059; BDBM22188 ...
MW:     464.546806 g/mol MF: C28H30F2N2O2
IUPAC name: 1-[4-[2-[bis(4-fluorophenyl)methoxy]ethyl]piperazin-1-yl]-3-...
Create Date: 2007-12-05
CID: 20443023

3995. CHEMBL512636; SCHEMBL10632151; BDBM22186 ...
MW:     480.589266 g/mol MF: C29H34F2N2O2
IUPAC name: 4-[4-[2-[bis(4-fluorophenyl)methoxy]ethyl]piperazin-1-yl]-2-...
Create Date: 2007-12-05
CID: 20443021

3996. F3071-0122; SMR000629009; MLS001124129 ...
MW:     499.587400 g/mol MF: C26H25N7O2S
IUPAC name: 3-(3,4-dimethylphenyl)sulfonyl-5-(4-pyridin-2-ylpiperazin-1-...
Create Date: 2007-12-04
CID: 18590459

3997. F1609-0764; PSTQ Analog, 3{7,31}; BDBM93379 ...
MW:     508.390320 g/mol MF: C23H18BrN5O2S
IUPAC name: 3-(4-bromophenyl)sulfonyl-N-(2-ethylphenyl)triazolo[1,5-a]qu...
Create Date: 2007-12-04
CID: 18560443

3998. F1609-0752; PSTQ Analog, 3{7,37}; BDBM93380 ...
MW:     508.390320 g/mol MF: C23H18BrN5O2S
IUPAC name: 3-(4-bromophenyl)sulfonyl-N-(2,3-dimethylphenyl)triazolo[1,5...
Create Date: 2007-12-04
CID: 18560433

3999. F1608-0149; PSTQ Analog, 3{8,31}; BDBM93381 ...
MW:     457.547420 g/mol MF: C25H23N5O2S
IUPAC name: 3-(2,5-dimethylphenyl)sulfonyl-N-(2-ethylphenyl)triazolo[1,5...
Create Date: 2007-12-04
CID: 18559732

4000. F1604-0111; SCHEMBL8026730; PSTQ Analog, 3{1,27} ...
MW:     421.515320 g/mol MF: C22H23N5O2S
IUPAC name: 3-(benzenesulfonyl)-N-(2-methylcyclohexyl)triazolo[1,5-a]qui...
Create Date: 2007-12-04
CID: 18559434

4001. F1603-0478; PSTQ Analog, 3{9,44}; BDBM93387 ...
MW:     471.574000 g/mol MF: C26H25N5O2S
IUPAC name: N-benzyl-3-(3,4-dimethylphenyl)sulfonyl-N-ethyltriazolo[1,5-...
Create Date: 2007-12-04
CID: 18559420

4002. PSTQ Analog, 3{2,10}; BDBM93357; MolPort-003-067-177 ...
MW:     457.547420 g/mol MF: C25H23N5O2S
IUPAC name: 3-(4-methylphenyl)sulfonyl-N-(2-phenylpropyl)triazolo[1,5-a]...
Create Date: 2007-12-04
CID: 18559154

4003. Benzimidazole urea analogue, 3; CHEMBL472525; SCHEMBL5075903 ...
MW:     280.324440 g/mol MF: C16H16N4O
IUPAC name: 1-ethyl-3-(6-phenyl-1H-benzimidazol-2-yl)urea
Create Date: 2007-12-04
CID: 18008864

4004. CHEMBL213662; Monocyclic thiophene analog 19; SCHEMBL3907441 ...
MW:     373.175960 g/mol MF: C13H9BrO6S
IUPAC name: 4-bromo-3-(carboxymethoxy)-5-(3-hydroxyphenyl)thiophene-2-ca...
Create Date: 2007-12-03
CID: 17758917

4005. F1605-0498; 3-[(4-chlorophenyl)sulfonyl]-N-(1-phenylethyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine; PSTQ Analog, 3{6,20} ...
MW:     463.939320 g/mol MF: C23H18ClN5O2S
IUPAC name: 3-(4-chlorophenyl)sulfonyl-N-(1-phenylethyl)triazolo[1,5-a]q...
Create Date: 2007-11-13
CID: 16815532

4006. PD173955 aminomethyl analogue; CHEBI:39079; 2-{[3-(aminomethyl)phenyl]amino}-6-(2,6-dichlorophenyl)-8-methylpyrido[2,3-d]pyrimidin-7(8H)-one
MW:     426.298580 g/mol MF: C21H17Cl2N5O
IUPAC name: 2-[3-(aminomethyl)anilino]-6-(2,6-dichlorophenyl)-8-methylpy...
Create Date: 2007-08-31
CID: 16722154

4007. CHEMBL219609; SCHEMBL1400824; BDBM21825 ...
MW:     511.629720 g/mol MF: C28H33NO6S
IUPAC name: 2-[(1S)-5-[3-[4-(4-ethoxy-5-ethyl-1,3-thiazol-2-yl)-2-methox...
Create Date: 2007-06-18
CID: 16110535

4008. CHEMBL222508; SCHEMBL1400402; BDBM21817 ...
MW:     469.549980 g/mol MF: C25H27NO6S
IUPAC name: 2-[(1S)-5-[3-[2-methoxy-4-(4-methoxy-1,3-thiazol-2-yl)phenox...
Create Date: 2007-06-18
CID: 16110534

4009. CHEMBL375072; SCHEMBL3120428; BDBM21815 ...
MW:     509.613840 g/mol MF: C28H31NO6S
IUPAC name: 2-[(1S)-5-[3-[4-[4-(carboxymethyl)-1,3-thiazol-2-yl]-2-propy...
Create Date: 2007-06-18
CID: 16110533

4010. CHEMBL427080; SCHEMBL1400614; BDBM21813 ...
MW:     497.560080 g/mol MF: C26H27NO7S
IUPAC name: 2-[4-[3-[[(1S)-1-(carboxymethyl)-2,3-dihydro-1H-inden-5-yl]o...
Create Date: 2007-06-18
CID: 16110532

4011. CHEMBL374545; SCHEMBL1400856; Indanylacetic Acid Analog, 34u ...
MW:     465.561280 g/mol MF: C26H27NO5S
IUPAC name: 2-[(1S)-5-[3-[4-(5-acetyl-4-methyl-1,3-thiazol-2-yl)phenoxy]...
Create Date: 2007-06-18
CID: 16110525

4012. CHEMBL375427; Indanylacetic Acid Analog, 34s; BDBM21804 ...
MW:     495.587260 g/mol MF: C27H29NO6S
IUPAC name: 2-[(1S)-5-[3-[4-(6,7-dihydro-5H-pyrano[2,3-d][1,3]thiazol-2-...
Create Date: 2007-06-18
CID: 16110524

4013. CHEMBL219817; Indanylacetic Acid Analog, 17v; BDBM21775 ...
MW:     450.487040 g/mol MF: C24H26N4O5
IUPAC name: 2-[(1S)-5-[3-[2-acetamido-4-(triazol-1-yl)phenoxy]propoxy]-2...
Create Date: 2007-06-18
CID: 16110519

4014. CHEMBL220430; SCHEMBL1400329; Indanylacetic Acid Analog, 17t ...
MW:     384.465420 g/mol MF: C23H28O5
IUPAC name: 2-[(1S)-5-[3-(2-ethoxy-4-methylphenoxy)propoxy]-2,3-dihydro-...
Create Date: 2007-06-18
CID: 16110518

4015. CHEMBL220681; SCHEMBL1400818; Indanylacetic Acid Analog, 17r ...
MW:     384.465420 g/mol MF: C23H28O5
IUPAC name: 2-[(1S)-5-[3-(4-ethyl-2-methoxyphenoxy)propoxy]-2,3-dihydro-...
Create Date: 2007-06-18
CID: 16110517

4016. CHEMBL375098; SCHEMBL3019309; Indanylacetic Acid Analog, 17m ...
MW:     368.466020 g/mol MF: C23H28O4
IUPAC name: 2-[(1S)-5-[3-(2-propylphenoxy)propoxy]-2,3-dihydro-1H-inden-...
Create Date: 2007-06-18
CID: 16110516

4017. CHEMBL373554; SCHEMBL1400271; Indanylacetic Acid Analog, 17k ...
MW:     356.412260 g/mol MF: C21H24O5
IUPAC name: 2-[(1S)-5-[3-(3-methoxyphenoxy)propoxy]-2,3-dihydro-1H-inden...
Create Date: 2007-06-18
CID: 16110515

4018. CHEMBL220628; SCHEMBL1400621; Indanylacetic Acid Analog, 17i ...
MW:     340.412860 g/mol MF: C21H24O4
IUPAC name: 2-[(1S)-5-[3-(3-methylphenoxy)propoxy]-2,3-dihydro-1H-inden-...
Create Date: 2007-06-18
CID: 16110514

4019. CHEMBL220508; SCHEMBL1400780; Indanylacetic Acid Analog, 17g ...
MW:     351.395740 g/mol MF: C21H21NO4
IUPAC name: 2-[(1S)-5-[3-(4-cyanophenoxy)propoxy]-2,3-dihydro-1H-inden-1...
Create Date: 2007-06-18
CID: 16110513

4020. CHEMBL373605; SCHEMBL1400262; Indanylacetic Acid Analog, 17d ...
MW:     410.383650 g/mol MF: C21H21F3O5
IUPAC name: 2-[(1S)-5-[3-[4-(trifluoromethoxy)phenoxy]propoxy]-2,3-dihyd...
Create Date: 2007-06-18
CID: 16110512

4021. CHEMBL220421; SCHEMBL1400619; Indanylacetic Acid Analog, 17b ...
MW:     354.439440 g/mol MF: C22H26O4
IUPAC name: 2-[(1S)-5-[3-(4-ethylphenoxy)propoxy]-2,3-dihydro-1H-inden-1...
Create Date: 2007-06-18
CID: 16110511

4022. CHEMBL436514; SCHEMBL1400496; BDBM21821 ...
MW:     509.656900 g/mol MF: C29H35NO5S
IUPAC name: 2-[(1S)-5-[3-[4-(4-propan-2-yloxy-1,3-thiazol-2-yl)-2-propyl...
Create Date: 2007-06-18
CID: 16110494

4023. CHEMBL223748; SCHEMBL1400573; BDBM21818 ...
MW:     453.550580 g/mol MF: C25H27NO5S
IUPAC name: 2-[(1S)-5-[3-[4-(4-ethoxy-1,3-thiazol-2-yl)phenoxy]propoxy]-...
Create Date: 2007-06-18
CID: 16110493

4024. CHEMBL424933; SCHEMBL1400982; BDBM21814 ...
MW:     525.613240 g/mol MF: C28H31NO7S
IUPAC name: 2-[4-[3-[[(1S)-1-(carboxymethyl)-2,3-dihydro-1H-inden-5-yl]o...
Create Date: 2007-06-18
CID: 16110492

4025. CHEMBL220173; SCHEMBL1400660; Indanylacetic Acid Analog, 34y ...
MW:     524.628480 g/mol MF: C28H32N2O6S
IUPAC name: 2-[(1S)-5-[3-[4-[5-(dimethylcarbamoyl)-4-methyl-1,3-thiazol-...
Create Date: 2007-06-18
CID: 16110491

4026. SCHEMBL1400218; CHEMBL2236890; Indanylacetic Acid Analog, 34r ...
MW:     507.641020 g/mol MF: C29H33NO5S
IUPAC name: 2-[(1S)-5-[3-[4-(6,7-dihydro-5H-pyrano[2,3-d][1,3]thiazol-2-...
Create Date: 2007-06-18
CID: 16110490

4027. CHEMBL375812; SCHEMBL1400287; Indanylacetic Acid Analog, 34o ...
MW:     463.588460 g/mol MF: C27H29NO4S
IUPAC name: 2-[(1S)-5-[3-[4-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)ph...
Create Date: 2007-06-18
CID: 16110489

4028. CHEMBL221101; SCHEMBL3122256; Indanylacetic Acid Analog, 34l ...
MW:     449.561880 g/mol MF: C26H27NO4S
IUPAC name: 2-[(1S)-5-[3-[4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-...
Create Date: 2007-06-18
CID: 16110488

4029. CHEMBL219687; SCHEMBL1400842; Indanylacetic Acid Analog, 34i ...
MW:     507.521970 g/mol MF: C25H24F3NO5S
IUPAC name: 2-[(1S)-5-[3-[2-methoxy-4-[4-(trifluoromethyl)-1,3-thiazol-2...
Create Date: 2007-06-18
CID: 16110487

4030. CHEMBL373813; SCHEMBL3023128; Indanylacetic Acid Analog, 34e ...
MW:     479.630920 g/mol MF: C28H33NO4S
IUPAC name: 2-[(1S)-5-[3-[4-(4-ethyl-1,3-thiazol-2-yl)-2-propylphenoxy]p...
Create Date: 2007-06-18
CID: 16110486

4031. CHEMBL220635; SCHEMBL1400693; Indanylacetic Acid Analog, 34d ...
MW:     437.551180 g/mol MF: C25H27NO4S
IUPAC name: 2-[(1S)-5-[3-[4-(4-ethyl-1,3-thiazol-2-yl)phenoxy]propoxy]-2...
Create Date: 2007-06-18
CID: 16110485

4032. CHEMBL220059; SCHEMBL1400323; Indanylacetic Acid Analog, 34c ...
MW:     453.550580 g/mol MF: C25H27NO5S
IUPAC name: 2-[(1S)-5-[3-[2-methoxy-4-(4-methyl-1,3-thiazol-2-yl)phenoxy...
Create Date: 2007-06-18
CID: 16110484

4033. CHEMBL220124; SCHEMBL1400868; Indanylacetic Acid Analog, 34b ...
MW:     439.524000 g/mol MF: C24H25NO5S
IUPAC name: 2-[(1S)-5-[3-[2-methoxy-4-(1,3-thiazol-2-yl)phenoxy]propoxy]...
Create Date: 2007-06-18
CID: 16110483

4034. CHEMBL374901; SCHEMBL1400247; Indanylacetic Acid Analog, 34a ...
MW:     451.577760 g/mol MF: C26H29NO4S
IUPAC name: 2-[(1S)-5-[3-[2-propyl-4-(1,3-thiazol-2-yl)phenoxy]propoxy]-...
Create Date: 2007-06-18
CID: 16110482

4035. CHEMBL220570; SCHEMBL1400566; Indanylacetic Acid Analog, 29i ...
MW:     471.468270 g/mol MF: C26H24F3NO4
IUPAC name: 2-[(1S)-5-[3-[4-[5-(trifluoromethyl)pyridin-2-yl]phenoxy]pro...
Create Date: 2007-06-18
CID: 16110444

4036. CHEMBL220325; SCHEMBL1400382; Indanylacetic Acid Analog, 29h ...
MW:     417.496880 g/mol MF: C26H27NO4
IUPAC name: 2-[(1S)-5-[3-[4-(6-methylpyridin-2-yl)phenoxy]propoxy]-2,3-d...
Create Date: 2007-06-18
CID: 16110443

4037. CHEMBL425116; SCHEMBL1400636; Indanylacetic Acid Analog, 29g ...
MW:     464.510320 g/mol MF: C26H28N2O6
IUPAC name: 2-[(1S)-5-[3-[4-(2,4-dimethoxypyrimidin-5-yl)phenoxy]propoxy...
Create Date: 2007-06-18
CID: 16110442

4038. CHEMBL220448; SCHEMBL1400268; Indanylacetic Acid Analog, 29f ...
MW:     404.458360 g/mol MF: C24H24N2O4
IUPAC name: 2-[(1S)-5-[3-(4-pyrimidin-5-ylphenoxy)propoxy]-2,3-dihydro-1...
Create Date: 2007-06-18
CID: 16110441

4039. CHEMBL220388; SCHEMBL1400769; Indanylacetic Acid Analog, 29e ...
MW:     433.496280 g/mol MF: C26H27NO5
IUPAC name: 2-[(1S)-5-[3-[4-(4-methoxypyridin-3-yl)phenoxy]propoxy]-2,3-...
Create Date: 2007-06-18
CID: 16110440

4040. CHEMBL219944; SCHEMBL1400495; Indanylacetic Acid Analog, 29d ...
MW:     403.470300 g/mol MF: C25H25NO4
IUPAC name: 2-[(1S)-5-[3-(4-pyridin-3-ylphenoxy)propoxy]-2,3-dihydro-1H-...
Create Date: 2007-06-18
CID: 16110439

4041. CHEMBL220893; SCHEMBL1400787; Indanylacetic Acid Analog, 29c ...
MW:     441.518280 g/mol MF: C28H27NO4
IUPAC name: 2-[(1S)-5-[3-[4-(1H-indol-6-yl)phenoxy]propoxy]-2,3-dihydro-...
Create Date: 2007-06-18
CID: 16110438

4042. CHEMBL376418; SCHEMBL1400869; Indanylacetic Acid Analog, 29b ...
MW:     392.444360 g/mol MF: C24H24O5
IUPAC name: 2-[(1S)-5-[3-[4-(furan-3-yl)phenoxy]propoxy]-2,3-dihydro-1H-...
Create Date: 2007-06-18
CID: 16110437

4043. CHEMBL375748; SCHEMBL1400569; Indanylacetic Acid Analog, 29a ...
MW:     408.509960 g/mol MF: C24H24O4S
IUPAC name: 2-[(1S)-5-[3-(4-thiophen-3-ylphenoxy)propoxy]-2,3-dihydro-1H...
Create Date: 2007-06-18
CID: 16110436

4044. CHEMBL220990; SCHEMBL1400260; Indanylacetic Acid Analog, 17w ...
MW:     427.880780 g/mol MF: C22H22ClN3O4
IUPAC name: 2-[(1S)-5-[3-[2-chloro-4-(1,2,4-triazol-4-yl)phenoxy]propoxy...
Create Date: 2007-06-18
CID: 16110429

4045. CHEMBL220431; Indanylacetic Acid Analog, 17u; BDBM21774 ...
MW:     393.435720 g/mol MF: C22H23N3O4
IUPAC name: 2-[(1S)-5-[3-[4-(1,2,4-triazol-1-yl)phenoxy]propoxy]-2,3-dih...
Create Date: 2007-06-18
CID: 16110428

4046. CHEMBL375747; SCHEMBL1400667; Indanylacetic Acid Analog, 17s ...
MW:     381.421720 g/mol MF: C22H23NO5
IUPAC name: 2-[(1S)-5-[3-(4-cyano-2-methoxyphenoxy)propoxy]-2,3-dihydro-...
Create Date: 2007-06-18
CID: 16110427

4047. CHEMBL220060; SCHEMBL1400278; Indanylacetic Acid Analog, 17q ...
MW:     370.438840 g/mol MF: C22H26O5
IUPAC name: 2-[(1S)-5-[3-(2-methoxy-4-methylphenoxy)propoxy]-2,3-dihydro...
Create Date: 2007-06-18
CID: 16110426

4048. CHEMBL219661; SCHEMBL1400255; Indanylacetic Acid Analog, 17o ...
MW:     393.475480 g/mol MF: C24H27NO4
IUPAC name: 2-[(1S)-5-[3-(4-cyano-2-propylphenoxy)propoxy]-2,3-dihydro-1...
Create Date: 2007-06-18
CID: 16110425

4049. CHEMBL220785; SCHEMBL3019471; Indanylacetic Acid Analog, 17l ...
MW:     354.439440 g/mol MF: C22H26O4
IUPAC name: 2-[(1S)-5-[3-(2,4-dimethylphenoxy)propoxy]-2,3-dihydro-1H-in...
Create Date: 2007-06-18
CID: 16110424

4050. CHEMBL376537; SCHEMBL1400523; Indanylacetic Acid Analog, 17j ...
MW:     354.439440 g/mol MF: C22H26O4
IUPAC name: 2-[(1S)-5-[3-(3,4-dimethylphenoxy)propoxy]-2,3-dihydro-1H-in...
Create Date: 2007-06-18
CID: 16110423

4051. CHEMBL220058; SCHEMBL1400449; Indanylacetic Acid Analog, 17h ...
MW:     402.482240 g/mol MF: C26H26O4
IUPAC name: 2-[(1S)-5-[3-(4-phenylphenoxy)propoxy]-2,3-dihydro-1H-inden-...
Create Date: 2007-06-18
CID: 16110422

4052. CHEMBL220507; SCHEMBL1400700; Indanylacetic Acid Analog, 17f ...
MW:     370.438840 g/mol MF: C22H26O5
IUPAC name: 2-[(1S)-5-[3-(4-ethoxyphenoxy)propoxy]-2,3-dihydro-1H-inden-...
Create Date: 2007-06-18
CID: 16110421

4053. CHEMBL220627; SCHEMBL1400338; Indanylacetic Acid Analog, 17e ...
MW:     356.412260 g/mol MF: C21H24O5
IUPAC name: 2-[(1S)-5-[3-(4-methoxyphenoxy)propoxy]-2,3-dihydro-1H-inden...
Create Date: 2007-06-18
CID: 16110420

4054. CHEMBL220422; SCHEMBL1400241; Indanylacetic Acid Analog, 17c ...
MW:     394.384250 g/mol MF: C21H21F3O4
IUPAC name: 2-[(1S)-5-[3-[4-(trifluoromethyl)phenoxy]propoxy]-2,3-dihydr...
Create Date: 2007-06-18
CID: 16110419

4055. CHEMBL374234; SCHEMBL1400217; Indanylacetic Acid Analog, 17a ...
MW:     326.386280 g/mol MF: C20H22O4
IUPAC name: 2-[(1S)-5-(3-phenoxypropoxy)-2,3-dihydro-1H-inden-1-yl]aceti...
Create Date: 2007-06-18
CID: 16110418

4056. CHEMBL221083; SCHEMBL1606137; 2-(S)-Phenethylamine analog 9 ...
MW:     310.842160 g/mol MF: C15H19ClN2OS
IUPAC name: 2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]-5-methyl-5-propan-2-...
Create Date: 2007-06-18
CID: 16105496

4057. CHEMBL220742; SCHEMBL1605322; 2-(S)-Phenethylamine analog 5 ...
MW:     344.395070 g/mol MF: C16H19F3N2OS
IUPAC name: 5-methyl-5-propan-2-yl-2-[[(1S)-1-[4-(trifluoromethyl)phenyl...
Create Date: 2007-06-18
CID: 16105495

4058. CHEMBL265625; SCHEMBL1604726; 2-(S)-Phenethylamine analog 7 ...
MW:     344.395070 g/mol MF: C16H19F3N2OS
IUPAC name: 5-methyl-5-propan-2-yl-2-[[(1S)-1-[2-(trifluoromethyl)phenyl...
Create Date: 2007-06-18
CID: 16105488

4059. CHEMBL221391; 2-(S)-Phenethylamine analog 6; SCHEMBL14429438 ...
MW:     344.395070 g/mol MF: C16H19F3N2OS
IUPAC name: 5-methyl-5-propan-2-yl-2-[[(1S)-1-[3-(trifluoromethyl)phenyl...
Create Date: 2007-06-18
CID: 16105487

4060. CHEMBL415625; 3-quinolinecarbonitrile analog 7; BDBM13046 ...
MW:     522.425700 g/mol MF: C27H25Cl2N5O2
IUPAC name: 4-(2,4-dichloro-5-methoxyanilino)-7-[5-[(4-methylpiperazin-1...
Create Date: 2007-06-18
CID: 16099169

4061. CHEMBL219260; 3-quinolinecarbonitrile analog 5; BDBM13045 ...
MW:     522.425700 g/mol MF: C27H25Cl2N5O2
IUPAC name: 4-(2,4-dichloro-5-methoxyanilino)-7-[5-[(4-methylpiperazin-1...
Create Date: 2007-06-18
CID: 16099168

4062. alpha-ketothiazole analogue 35; CHEMBL412546; BDBM12975 ...
MW:     752.724180 g/mol MF: C34H42BrN9O4S
IUPAC name: (2S)-2-[[(2S)-2-[[(1R)-1-(4-bromophenyl)ethyl]carbamoylamino...
Create Date: 2007-06-18
CID: 16098913

4063. alpha-ketothiazole analogue 34; CHEMBL265121; BDBM12974 ...
MW:     680.616920 g/mol MF: C27H38BrN9O5S
IUPAC name: (2S)-2-[[(1R)-1-(4-bromophenyl)ethyl]carbamoylamino]-N-[(2S)...
Create Date: 2007-06-18
CID: 16098912

4064. alpha-ketothiazole analogue 33; CHEMBL384971; BDBM12973 ...
MW:     722.699960 g/mol MF: C29H44BrN11O4S
IUPAC name: (2S)-2-[[(1R)-1-(4-bromophenyl)ethyl]carbamoylamino]-5-(diam...
Create Date: 2007-06-18
CID: 16098911

4065. alpha-ketothiazole analogue 32; CHEMBL413155; BDBM12972 ...
MW:     729.687540 g/mol MF: C32H41BrN8O5S
IUPAC name: (2S)-2-[[(2S)-2-[[(1R)-1-(4-bromophenyl)ethyl]carbamoylamino...
Create Date: 2007-06-18
CID: 16098910

4066. alpha-ketothiazole analogue 31; CHEMBL273652; BDBM12971 ...
MW:     653.770603 g/mol MF: C31H40FN9O4S
IUPAC name: (2S)-N-[(2S)-5-(diaminomethylideneamino)-1-oxo-1-(1,3-thiazo...
Create Date: 2007-06-18
CID: 16098909

4067. alpha-ketothiazole analogue 30; CHEMBL268003; BDBM12970 ...
MW:     653.770603 g/mol MF: C31H40FN9O4S
IUPAC name: (2S)-N-[(2S)-5-(diaminomethylideneamino)-1-oxo-1-(1,3-thiazo...
Create Date: 2007-06-18
CID: 16098908

4068. alpha-ketothiazole analogue 29; CHEMBL384693; BDBM12969 ...
MW:     705.709200 g/mol MF: C31H45BrN8O4S
IUPAC name: (2S)-2-[[(2S)-2-[[(1S)-1-(4-bromophenyl)ethyl]carbamoylamino...
Create Date: 2007-06-18
CID: 16098907

4069. alpha-ketothiazole analogue 28; CHEMBL375816; BDBM12968 ...
MW:     705.709200 g/mol MF: C31H45BrN8O4S
IUPAC name: (2S)-2-[[(2S)-2-[[(1R)-1-(4-bromophenyl)ethyl]carbamoylamino...
Create Date: 2007-06-18
CID: 16098906

4070. alpha-ketothiazole analogue 27; CHEMBL216110; BDBM12967 ...
MW:     495.638680 g/mol MF: C22H37N7O4S
IUPAC name: (2S)-2-acetamido-N-[(2S)-1-[[(2S)-5-(diaminomethylideneamino...
Create Date: 2007-06-18
CID: 16098905

4071. alpha-ketothiazole analogue 26; CHEMBL273666; BDBM12966 ...
MW:     587.734040 g/mol MF: C28H41N7O5S
IUPAC name: benzyl N-[(2S)-1-[[(2S)-1-[[(2S)-5-(diaminomethylideneamino)...
Create Date: 2007-06-18
CID: 16098904

4072. alpha-ketothiazole analogue 25; CHEMBL218594; BDBM12965 ...
MW:     586.749280 g/mol MF: C28H42N8O4S
IUPAC name: (2S)-2-(benzylcarbamoylamino)-N-[(2S)-1-[[(2S)-5-(diaminomet...
Create Date: 2007-06-18
CID: 16098903

4073. alpha-ketothiazole analogue 24; CHEMBL100320; BDBM12964 ...
MW:     604.739743 g/mol MF: C28H41FN8O4S
IUPAC name: (2S)-N-[(2S)-1-[[(2S)-5-(diaminomethylideneamino)-1-oxo-1-(1...
Create Date: 2007-06-18
CID: 16098902

4074. alpha-ketothiazole analogue 23; CHEMBL375599; BDBM12963 ...
MW:     655.639400 g/mol MF: C28H40Cl2N8O4S
IUPAC name: (2S)-N-[(2S)-1-[[(2S)-5-(diaminomethylideneamino)-1-oxo-1-(1...
Create Date: 2007-06-18
CID: 16098901

4075. alpha-ketothiazole analogue 22; CHEMBL119057; BDBM12962 ...
MW:     679.671920 g/mol MF: C29H43BrN8O4S
IUPAC name: (2S)-2-[1-(4-bromophenyl)ethylcarbamoylamino]-N-[(2S)-1-[[(2...
Create Date: 2007-06-18
CID: 16098900

4076. alpha-ketothiazole analogue 21; CHEMBL265598; BDBM12961 ...
MW:     669.665980 g/mol MF: C29H42Cl2N8O4S
IUPAC name: (2S)-N-[(2S)-1-[[(2S)-5-(diaminomethylideneamino)-1-oxo-1-(1...
Create Date: 2007-06-18
CID: 16098899

4077. alpha-ketothiazole analogue 20; CHEMBL219354; BDBM12960 ...
MW:     627.586240 g/mol MF: C26H36Cl2N8O4S
IUPAC name: (2S)-N-[(2S)-1-[[(2S)-5-(diaminomethylideneamino)-1-oxo-1-(1...
Create Date: 2007-06-18
CID: 16098898

4078. alpha-ketothiazole analogue 19; CHEMBL375598; BDBM12959 ...
MW:     703.682200 g/mol MF: C32H40Cl2N8O4S
IUPAC name: (2S)-N-[(2S)-1-[[(2S)-5-(diaminomethylideneamino)-1-oxo-1-(1...
Create Date: 2007-06-18
CID: 16098897

4079. alpha-ketothiazole analogue 18; CHEMBL219462; BDBM12958 ...
MW:     695.703260 g/mol MF: C31H44Cl2N8O4S
IUPAC name: (2S)-N-[(1S)-1-cyclohexyl-2-[[(2S)-5-(diaminomethylideneamin...
Create Date: 2007-06-18
CID: 16098896

4080. alpha-ketothiazole analogue 17; CHEMBL375597; BDBM12957 ...
MW:     719.681600 g/mol MF: C32H40Cl2N8O5S
IUPAC name: (2S)-N-[(2S)-1-[[(2S)-5-(diaminomethylideneamino)-1-oxo-1-(1...
Create Date: 2007-06-18
CID: 16098895

4081. CHEMBL217038; SCHEMBL10174275; BDBM12315 ...
MW:     545.713980 g/mol MF: C29H47N5O5
IUPAC name: (1R,2S,5S)-N-(4-amino-1-cyclobutyl-3,4-dioxobutan-2-yl)-3-[(...
Create Date: 2007-06-18
CID: 16087210

4082. CHEMBL386569; BDBM12313; SCH 503034 Analogue 72 ...
MW:     533.703280 g/mol MF: C28H47N5O5
IUPAC name: (1R,2S,5S)-N-(4-amino-1-cyclobutyl-3,4-dioxobutan-2-yl)-3-[(...
Create Date: 2007-06-18
CID: 16087209

4083. CHEMBL265623; SCHEMBL10140504; BDBM12310 ...
MW:     503.634240 g/mol MF: C26H41N5O5
IUPAC name: (1R,2S,5S)-N-(4-amino-1-cyclopropyl-3,4-dioxobutan-2-yl)-3-[...
Create Date: 2007-06-18
CID: 16087208

4084. CHEMBL217302; SCHEMBL13691572; BDBM12308 ...
MW:     547.729860 g/mol MF: C29H49N5O5
IUPAC name: (1R,2S,5S)-N-(4-amino-1-cyclobutyl-3,4-dioxobutan-2-yl)-3-[(...
Create Date: 2007-06-18
CID: 16087207

4085. CHEMBL276695; SCHEMBL13689627; BDBM12306 ...
MW:     491.623540 g/mol MF: C25H41N5O5
IUPAC name: (1R,2S,5S)-N-(4-amino-1-cyclopropyl-3,4-dioxobutan-2-yl)-3-[...
Create Date: 2007-06-18
CID: 16087206

4086. CHEMBL216880; SCHEMBL10140692; BDBM12304 ...
MW:     506.634880 g/mol MF: C26H42N4O6
IUPAC name: 2-methylpropyl N-[(2S)-1-[(1R,2S,5S)-2-[(4-amino-1-cycloprop...
Create Date: 2007-06-18
CID: 16087205

4087. CHEMBL386605; SCHEMBL10140345; BDBM12302 ...
MW:     492.608300 g/mol MF: C25H40N4O6
IUPAC name: propan-2-yl N-[(2S)-1-[(1R,2S,5S)-2-[(4-amino-1-cyclopropyl-...
Create Date: 2007-06-18
CID: 16087204

4088. CHEMBL436923; SCHEMBL14583436; BDBM12295 ...
MW:     566.688380 g/mol MF: C31H42N4O6
IUPAC name: tert-butyl N-[(1S)-2-[(1R,2S,5S)-2-[(4-amino-1-cyclopropyl-3...
Create Date: 2007-06-18
CID: 16087201

4089. CHEMBL217520; SCHEMBL10140310; BDBM12293 ...
MW:     492.608300 g/mol MF: C25H40N4O6
IUPAC name: tert-butyl N-[(2S)-1-[(1R,2S,5S)-2-[(4-amino-1-cyclopropyl-3...
Create Date: 2007-06-18
CID: 16087200

4090. BDBM12291; SCH 503034 Analogue 50; 1,1-dimethylethyl-[2-[(1R,5S)-2(S)-[[[3-amino-1-(2-oxetanylmethyl)-2,3-dioxopropyl]amino]carbonyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl]-1(S)-cyclohexyl-2-oxoethyl]carbamates ...
MW:     548.671560 g/mol MF: C28H44N4O7
IUPAC name: tert-butyl N-[(1S)-2-[(1R,2S,5S)-2-[[4-amino-1-(oxetan-2-yl)...
Create Date: 2007-06-18
CID: 16087199

4091. CHEMBL217603; BDBM12288; SCH 503034 Analogue 47 ...
MW:     560.725320 g/mol MF: C30H48N4O6
IUPAC name: tert-butyl N-[(1S)-2-[(1R,2S,5S)-2-[(4-amino-1-cyclopentyl-3...
Create Date: 2007-06-18
CID: 16087198

4092. CHEMBL216906; SCHEMBL10140255; BDBM12286 ...
MW:     532.672160 g/mol MF: C28H44N4O6
IUPAC name: tert-butyl N-[(1S)-2-[(1R,2S,5S)-2-[(4-amino-1-cyclopropyl-3...
Create Date: 2007-06-18
CID: 16087197

4093. CHEMBL384034; SCHEMBL10140279; BDBM12283 ...
MW:     532.672160 g/mol MF: C28H44N4O6
IUPAC name: tert-butyl N-[(1S)-2-[(1R,2S,5S)-2-[(1-amino-1,2-dioxohept-6...
Create Date: 2007-06-18
CID: 16087196

4094. CHEMBL217827; SCHEMBL10140379; BDBM12314 ...
MW:     531.687400 g/mol MF: C28H45N5O5
IUPAC name: (1R,2S,5S)-N-(4-amino-1-cyclopropyl-3,4-dioxobutan-2-yl)-3-[...
Create Date: 2007-06-18
CID: 16087171

4095. CHEMBL216963; BDBM12312; SCH 503034 Analogue 71 ...
MW:     519.676700 g/mol MF: C27H45N5O5
IUPAC name: (1R,2S,5S)-N-(4-amino-1-cyclopropyl-3,4-dioxobutan-2-yl)-3-[...
Create Date: 2007-06-18
CID: 16087170

4096. CHEMBL387020; SCHEMBL10140469; BDBM12309 ...
MW:     505.650120 g/mol MF: C26H43N5O5
IUPAC name: (1R,2S,5S)-N-(4-amino-1-cyclopropyl-3,4-dioxobutan-2-yl)-3-[...
Create Date: 2007-06-18
CID: 16087169

4097. CHEMBL217289; SCHEMBL10140690; BDBM12303 ...
MW:     490.592420 g/mol MF: C25H38N4O6
IUPAC name: cyclopropyl N-[(2S)-1-[(1R,2S,5S)-2-[(4-amino-1-cyclopropyl-...
Create Date: 2007-06-18
CID: 16087168

4098. CHEMBL384397; SCHEMBL13691399; BDBM12301 ...
MW:     522.634280 g/mol MF: C26H42N4O7
IUPAC name: tert-butyl N-[(2S)-1-[(1R,2S,5S)-2-[(4-amino-1-cyclobutyl-3,...
Create Date: 2007-06-18
CID: 16087167

4099. CHEMBL217050; SCHEMBL14377897; BDBM12298 ...
MW:     520.661460 g/mol MF: C27H44N4O6
IUPAC name: tert-butyl N-[(2S)-1-[(1R,2S,5S)-2-[(4-amino-1-cyclobutyl-3,...
Create Date: 2007-06-18
CID: 16087165

4100. CHEMBL386588; BDBM12296; SCH 503034 Analogue 55 ...
MW:     580.714960 g/mol MF: C32H44N4O6
IUPAC name: tert-butyl N-[(1S)-2-[(1R,2S,5S)-2-[(4-amino-1-cyclobutyl-3,...
Create Date: 2007-06-18
CID: 16087164

4101. CHEMBL217021; SCHEMBL10140302; BDBM12294 ...
MW:     518.645580 g/mol MF: C27H42N4O6
IUPAC name: tert-butyl N-[(1S)-2-[(1R,2S,5S)-2-[(4-amino-1-cyclopropyl-3...
Create Date: 2007-06-18
CID: 16087163

4102. SCHEMBL10140556; BDBM12292; SCH 503034 Analogue 51 ...
MW:     560.606270 g/mol MF: C26H39F3N4O6
IUPAC name: tert-butyl N-[(1S)-2-[(1R,2S,5S)-2-[(5-amino-1,1,1-trifluoro...
Create Date: 2007-06-18
CID: 16087162

4103. CHEMBL383980; BDBM12290; SCH 503034 Analogue 49 ...
MW:     548.671560 g/mol MF: C28H44N4O7
IUPAC name: tert-butyl N-[(1S)-2-[(1R,2S,5S)-2-[[4-amino-1-(oxetan-3-yl)...
Create Date: 2007-06-18
CID: 16087161

4104. CHEMBL216457; BDBM12289; SCH 503034 Analogue 48 ...
MW:     574.751900 g/mol MF: C31H50N4O6
IUPAC name: tert-butyl N-[(1S)-2-[(1R,2S,5S)-2-[(4-amino-1-cyclohexyl-3,...
Create Date: 2007-06-18
CID: 16087160

4105. CHEMBL217880; SCHEMBL10140306; BDBM12285 ...
MW:     534.688040 g/mol MF: C28H46N4O6
IUPAC name: tert-butyl N-[(1S)-2-[(1R,2S,5S)-2-[(1-amino-5-methyl-1,2-di...
Create Date: 2007-06-18
CID: 16087158

4106. CHEMBL265496; BDBM12284; SCH 503034 Analogue 43 ...
MW:     532.672160 g/mol MF: C28H44N4O6
IUPAC name: tert-butyl N-[(1S)-2-[(1R,2S,5S)-2-[(1-amino-5-methyl-1,2-di...
Create Date: 2007-06-18
CID: 16087157

4107. CHEMBL425450; SCHEMBL10140440; BDBM12282 ...
MW:     506.634880 g/mol MF: C26H42N4O6
IUPAC name: tert-butyl N-[(1S)-2-[(1R,2S,5S)-2-[(1-amino-1,2-dioxopentan...
Create Date: 2007-06-18
CID: 16087156

4108. CHEMBL217851; SCHEMBL10140320; BDBM12281 ...
MW:     504.619000 g/mol MF: C26H40N4O6
IUPAC name: tert-butyl N-[(1S)-1-cyclohexyl-2-[(1R,2S,5S)-6,6-dimethyl-2...
Create Date: 2007-06-18
CID: 16087155

4109. CHEMBL216849; BDBM12280; SCH 503034 Analogue 39 ...
MW:     521.646220 g/mol MF: C27H43N3O7
IUPAC name: 3-[[(1R,2S,5S)-3-[(2S)-2-cyclohexyl-2-[(2-methylpropan-2-yl)...
Create Date: 2007-06-18
CID: 16087154

4110. CHEMBL217350; SCHEMBL10140250; BDBM12278 ...
MW:     520.661460 g/mol MF: C27H44N4O6
IUPAC name: tert-butyl N-[(1S)-2-[(1R,2S,5S)-2-[(1-amino-1,2-dioxohexan-...
Create Date: 2007-06-18
CID: 16087152

4111. CHEMBL215302; SCHEMBL10141159; BDBM12276 ...
MW:     560.725320 g/mol MF: C30H48N4O6
IUPAC name: tert-butyl N-[(1S)-1-cyclohexyl-2-[(1R,2S,5S)-2-[[1,2-dioxo-...
Create Date: 2007-06-18
CID: 16087150

4112. CHEMBL383866; BDBM12275; SCH 503034 Analogue 34 ...
MW:     576.767780 g/mol MF: C31H52N4O6
IUPAC name: tert-butyl N-[(1S)-2-[(1R,2S,5S)-2-[[1-(butylamino)-1,2-diox...
Create Date: 2007-06-18
CID: 16087149

4113. CHEMBL438094; SCHEMBL13690927; BDBM12274 ...
MW:     696.873240 g/mol MF: C38H56N4O8
IUPAC name: 2-phenylpropan-2-yl 2-[[3-[[(1R,2S,5S)-3-[(2S)-2-cyclohexyl-...
Create Date: 2007-06-18
CID: 16087148

4114. CHEMBL409211; BDBM12273; SCH 503034 Analogue 32 ...
MW:     687.909540 g/mol MF: C37H61N5O7
IUPAC name: tert-butyl N-[(1S)-1-cyclohexyl-2-[(1R,2S,5S)-2-[[1-[[2-[[(1...
Create Date: 2007-06-18
CID: 16087147

4115. CHEMBL265083; BDBM12272; SCH 503034 Analogue 31 ...
MW:     687.909540 g/mol MF: C37H61N5O7
IUPAC name: tert-butyl N-[(1S)-1-cyclohexyl-2-[(1R,2S,5S)-2-[[1-[[2-[[(1...
Create Date: 2007-06-18
CID: 16087146

4116. CHEMBL426158; BDBM12271; SCH 503034 Analogue 30 ...
MW:     577.712780 g/mol MF: C29H47N5O7
IUPAC name: tert-butyl N-[(1S)-2-[(1R,2S,5S)-2-[[1-[(2-amino-2-oxoethyl)...
Create Date: 2007-06-18
CID: 16087145

4117. CHEMBL386898; BDBM12270; SCH 503034 Analogue 29 ...
MW:     631.803220 g/mol MF: C33H53N5O7
IUPAC name: tert-butyl N-[(1S)-1-cyclohexyl-2-[(1R,2S,5S)-2-[[1-[[2-(cyc...
Create Date: 2007-06-18
CID: 16087144

4118. CHEMBL267595; BDBM12269; SCH 503034 Analogue 28 ...
MW:     681.861900 g/mol MF: C37H55N5O7
IUPAC name: tert-butyl N-[(1S)-1-cyclohexyl-2-[(1R,2S,5S)-2-[[1,2-dioxo-...
Create Date: 2007-06-18
CID: 16087143

4119. CHEMBL268544; BDBM12268; SCH 503034 Analogue 27 ...
MW:     673.863040 g/mol MF: C34H51N5O7S
IUPAC name: tert-butyl N-[(1S)-1-cyclohexyl-2-[(1R,2S,5S)-2-[[1,2-dioxo-...
Create Date: 2007-06-18
CID: 16087142

4120. CHEMBL218133; SCHEMBL13690718; BDBM12267 ...
MW:     667.835320 g/mol MF: C36H53N5O7
IUPAC name: tert-butyl N-[(1S)-2-[(1R,2S,5S)-2-[[1-[[2-(benzylamino)-2-o...
Create Date: 2007-06-18
CID: 16087141

4121. T0901317 analogue, 9; CHEMBL396952; BDBM21670 ...
MW:     495.478339 g/mol MF: C22H23F6NO3S
IUPAC name: N-[4-(1-cyclohexyl-2,2,2-trifluoro-1-hydroxyethyl)phenyl]-N-...
Create Date: 2007-06-04
CID: 16072077

4122. Monocyclic thiophene analog 36; CHEMBL215335; SCHEMBL3903817 ...
MW:     458.237380 g/mol MF: C16H12BrNO8S
IUPAC name: 4-bromo-5-[4-[(2-carboxyacetyl)amino]phenyl]-3-(carboxymetho...
Create Date: 2007-04-30
CID: 16046117

4123. Spiro-indolinone analogue, 56; CHEMBL409310; SCHEMBL2482404 ...
MW:     424.833780 g/mol MF: C22H17ClN2O5
IUPAC name: 2-[5-chloro-2,2',5'-trioxo-1'-[(E)-3-phenylprop-2-enyl]spiro...
Create Date: 2007-03-07
CID: 15950276

4124. Spiro-indolinone analogue, 55; CHEMBL261316; SCHEMBL2484940 ...
MW:     412.823080 g/mol MF: C21H17ClN2O5
IUPAC name: 2-[5-chloro-2,2',5'-trioxo-1'-(2-phenylethyl)spiro[indole-3,...
Create Date: 2007-03-07
CID: 15950274

4125. Spiro-indolinone analogue, 57; CHEMBL410423; SCHEMBL2480601 ...
MW:     412.823080 g/mol MF: C21H17ClN2O5
IUPAC name: 2-[5-chloro-2,2',5'-trioxo-1'-(1-phenylethyl)spiro[indole-3,...
Create Date: 2007-03-07
CID: 15950273

4126. Spiro-indolinone analogue, 63; CHEMBL261124; SCHEMBL2482396 ...
MW:     428.822480 g/mol MF: C21H17ClN2O6
IUPAC name: 2-[5-chloro-1'-[(3-methoxyphenyl)methyl]-2,2',5'-trioxospiro...
Create Date: 2007-03-07
CID: 15950186

4127. Spiro-indolinone analogue, 61; CHEMBL412152; SCHEMBL2485739 ...
MW:     433.241560 g/mol MF: C20H14Cl2N2O5
IUPAC name: 2-[5-chloro-1'-[(4-chlorophenyl)methyl]-2,2',5'-trioxospiro[...
Create Date: 2007-03-07
CID: 15950184

4128. Spiro-indolinone analogue, 59; CHEMBL258856; SCHEMBL2484215 ...
MW:     416.786963 g/mol MF: C20H14ClFN2O5
IUPAC name: 2-[5-chloro-1'-[(4-fluorophenyl)methyl]-2,2',5'-trioxospiro[...
Create Date: 2007-03-07
CID: 15950103

4129. 916046-55-4; 5-chloro-1'-[(2-fluorophenyl)methyl]-2,2',5'-trioxo-spiro[3H-indole-3,3'-pyrrolidine-1(2H)-acetic acid; C20H14ClFN2O5 ...
MW:     416.786963 g/mol MF: C20H14ClFN2O5
IUPAC name: 2-[5-chloro-1'-[(2-fluorophenyl)methyl]-2,2',5'-trioxospiro[...
Create Date: 2007-03-07
CID: 15950102

4130. Spiro-indolinone analogue, 60; CHEMBL259069; SCHEMBL2482610 ...
MW:     433.241560 g/mol MF: C20H14Cl2N2O5
IUPAC name: 2-[5-chloro-1'-[(3-chlorophenyl)methyl]-2,2',5'-trioxospiro[...
Create Date: 2007-03-07
CID: 15950100

4131. Spiro-indolinone analogue, 76; CHEMBL260215; SCHEMBL2483159 ...
MW:     419.838860 g/mol MF: C18H14ClN3O5S
IUPAC name: 2-[5-chloro-1'-[(2-methyl-1,3-thiazol-4-yl)methyl]-2,2',5'-t...
Create Date: 2007-03-07
CID: 15950020

4132. Spiro-indolinone analogue, 73; CHEMBL259454; SCHEMBL2481301 ...
MW:     451.232023 g/mol MF: C20H13Cl2FN2O5
IUPAC name: 2-[5-chloro-1'-[(3-chloro-5-fluorophenyl)methyl]-2,2',5'-tri...
Create Date: 2007-03-07
CID: 15949852

4133. Spiro-indolinone analogue, 74; CHEMBL261764; SCHEMBL2485180 ...
MW:     446.812943 g/mol MF: C21H16ClFN2O6
IUPAC name: 2-[5-chloro-1'-[(3-fluoro-4-methoxyphenyl)methyl]-2,2',5'-tr...
Create Date: 2007-03-07
CID: 15949851

4134. Spiro-indolinone analogue, 69; CHEMBL260241; SCHEMBL2482443 ...
MW:     434.777426 g/mol MF: C20H13ClF2N2O5
IUPAC name: 2-[5-chloro-1'-[(3,4-difluorophenyl)methyl]-2,2',5'-trioxosp...
Create Date: 2007-03-07
CID: 15949849

4135. Spiro-indolinone analogue, 68; CHEMBL261847; SCHEMBL2480286 ...
MW:     434.777426 g/mol MF: C20H13ClF2N2O5
IUPAC name: 2-[5-chloro-1'-[(3,5-difluorophenyl)methyl]-2,2',5'-trioxosp...
Create Date: 2007-03-07
CID: 15949765

4136. Spiro-indolinone analogue, 66; CHEMBL411429; SCHEMBL2483067 ...
MW:     434.777426 g/mol MF: C20H13ClF2N2O5
IUPAC name: 2-[5-chloro-1'-[(2,3-difluorophenyl)methyl]-2,2',5'-trioxosp...
Create Date: 2007-03-07
CID: 15949764

4137. Spiro-indolinone analogue, 67; CHEMBL258477; SCHEMBL2480429 ...
MW:     434.777426 g/mol MF: C20H13ClF2N2O5
IUPAC name: 2-[5-chloro-1'-[(2,5-difluorophenyl)methyl]-2,2',5'-trioxosp...
Create Date: 2007-03-07
CID: 15949763

4138. Spiro-indolinone analogue, 70; CHEMBL263145; SCHEMBL2480588 ...
MW:     451.232023 g/mol MF: C20H13Cl2FN2O5
IUPAC name: 2-[5-chloro-1'-[(2-chloro-5-fluorophenyl)methyl]-2,2',5'-tri...
Create Date: 2007-03-07
CID: 15949762

4139. Spiro-indolinone analogue, 83; CHEMBL438208; SCHEMBL2483258 ...
MW:     388.758620 g/mol MF: C18H13ClN2O6
IUPAC name: 2-[5-chloro-1'-(furan-3-ylmethyl)-2,2',5'-trioxospiro[indole...
Create Date: 2007-03-07
CID: 15949761

4140. Spiro-indolinone analogue, 75; CHEMBL259521; SCHEMBL2482023 ...
MW:     453.835240 g/mol MF: C21H16ClN5O5
IUPAC name: 2-[5-chloro-1'-[(1-methylbenzotriazol-5-yl)methyl]-2,2',5'-t...
Create Date: 2007-03-07
CID: 15949760

4141. Spiro-indolinone analogue, 81; CHEMBL411535; SCHEMBL2482653 ...
MW:     389.746680 g/mol MF: C17H12ClN3O6
IUPAC name: 2-[5-chloro-1'-(1,3-oxazol-2-ylmethyl)-2,2',5'-trioxospiro[i...
Create Date: 2007-03-07
CID: 15949759

4142. Spiro-indolinone analogue, 29; CHEMBL260272; SCHEMBL2483483 ...
MW:     422.824500 g/mol MF: C20H15ClN6O3
IUPAC name: 1'-benzyl-5-chloro-1-(2H-tetrazol-5-ylmethyl)spiro[indole-3,...
Create Date: 2007-03-07
CID: 15949676

4143. Spiro-indolinone analogue, 88; CHEMBL411308; SCHEMBL2485522 ...
MW:     457.863700 g/mol MF: C22H20ClN3O6
IUPAC name: 2-[5-chloro-1'-[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]-...
Create Date: 2007-03-07
CID: 15949579

4144. Spiro-indolinone analogue, 82; CHEMBL260026; SCHEMBL2480766 ...
MW:     446.864200 g/mol MF: C19H15ClN4O5S
IUPAC name: 2-[5-chloro-1'-[(5-cyclopropyl-1,3,4-thiadiazol-2-yl)methyl]...
Create Date: 2007-03-07
CID: 15949578

4145. Spiro-indolinone analogue, 80; CHEMBL263408; SCHEMBL2483984 ...
MW:     446.841060 g/mol MF: C20H19ClN4O6
IUPAC name: 2-[1'-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]-5-chloro-2...
Create Date: 2007-03-07
CID: 15949577

4146. Spiro-indolinone analogue, 85; CHEMBL409096; SCHEMBL2485753 ...
MW:     417.799840 g/mol MF: C19H16ClN3O6
IUPAC name: 2-[5-chloro-1'-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2,2',5...
Create Date: 2007-03-07
CID: 15949576

4147. Spiro-indolinone analogue, 84; CHEMBL263144; SCHEMBL2484404 ...
MW:     437.832540 g/mol MF: C22H16ClN3O5
IUPAC name: 2-[5-chloro-1'-(1H-indol-3-ylmethyl)-2,2',5'-trioxospiro[ind...
Create Date: 2007-03-07
CID: 15949483

4148. CAY10595; 916047-16-0; Spiro-indolinone analogue, 71 ...
MW:     451.232023 g/mol MF: C20H13Cl2FN2O5
IUPAC name: 2-[5-chloro-1'-[(5-chloro-2-fluorophenyl)methyl]-2,2',5'-tri...
Create Date: 2007-03-07
CID: 15949395

4149. Spiro-indolinone analogue, 65; CHEMBL409632; SCHEMBL2482487 ...
MW:     476.886880 g/mol MF: C21H17ClN2O7S
IUPAC name: 2-[5-chloro-1'-[(4-methylsulfonylphenyl)methyl]-2,2',5'-trio...
Create Date: 2007-03-07
CID: 15949302

4150. Spiro-indolinone analogue, 62; CHEMBL260927; SCHEMBL2482562 ...
MW:     428.822480 g/mol MF: C21H17ClN2O6
IUPAC name: 2-[5-chloro-1'-[(2-methoxyphenyl)methyl]-2,2',5'-trioxospiro...
Create Date: 2007-03-07
CID: 15949301

4151. Spiro-indolinone analogue, 64; CHEMBL411430; SCHEMBL2480468 ...
MW:     490.891860 g/mol MF: C26H19ClN2O6
IUPAC name: 2-[5-chloro-2,2',5'-trioxo-1'-[(4-phenoxyphenyl)methyl]spiro...
Create Date: 2007-03-07
CID: 15949300

4152. Spiro-indolinone analogue, 72; CHEMBL261675; SCHEMBL2484762 ...
MW:     467.686620 g/mol MF: C20H13Cl3N2O5
IUPAC name: 2-[5-chloro-1'-[(3,5-dichlorophenyl)methyl]-2,2',5'-trioxosp...
Create Date: 2007-03-07
CID: 15949299

4153. Spiro-indolinone analogue, 52; CHEMBL259286; SCHEMBL2482677 ...
MW:     444.840123 g/mol MF: C22H18ClFN2O5
IUPAC name: 4-[5-chloro-1'-[(2-fluorophenyl)methyl]-2,2',5'-trioxospiro[...
Create Date: 2007-03-07
CID: 15949202

4154. Spiro-indolinone analogue, 53; CHEMBL411856; SCHEMBL2482306 ...
MW:     456.875640 g/mol MF: C23H21ClN2O6
IUPAC name: 4-[5-chloro-1'-[(4-methoxyphenyl)methyl]-2,2',5'-trioxospiro...
Create Date: 2007-03-07
CID: 15949201

4155. Spiro-indolinone analogue, 54; CHEMBL259285; SCHEMBL2483168 ...
MW:     461.294720 g/mol MF: C22H18Cl2N2O5
IUPAC name: 4-[5-chloro-1'-[(4-chlorophenyl)methyl]-2,2',5'-trioxospiro[...
Create Date: 2007-03-07
CID: 15949007

4156. Spiro-indolinone analogue, 15; CHEMBL264143; SCHEMBL2485190 ...
MW:     426.849660 g/mol MF: C22H19ClN2O5
IUPAC name: 4-(1'-benzyl-5-chloro-2,2',5'-trioxospiro[indole-3,3'-pyrrol...
Create Date: 2007-03-07
CID: 15948907

4157. CHEMBL373413; Monocyclic thiophene analog 10; SCHEMBL3903300 ...
MW:     359.976660 g/mol MF: C7H4Br2O5S
IUPAC name: 4,5-dibromo-3-(carboxymethoxy)thiophene-2-carboxylic acid
Create Date: 2007-02-12
CID: 15588116

4158. CHEMBL26649; BDBM22198; GBR 12935 Analogue, 38 ...
MW:     436.536706 g/mol MF: C27H30F2N2O
IUPAC name: 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-(2-phenylethyl)pip...
Create Date: 2007-02-08
CID: 12634880

4159. CHEMBL313406; CGS 27023A Analog 61; BDBM13129 ...
MW:     555.642520 g/mol MF: C28H33N3O7S
IUPAC name: benzyl N-[(5R)-5-[benzyl-(4-methoxyphenyl)sulfonylamino]-6-(...
Create Date: 2006-10-27
CID: 11800904

4160. CHEMBL84918; SCHEMBL7346338; CGS 27023A Analog 53 ...
MW:     440.512060 g/mol MF: C23H24N2O5S
IUPAC name: (2R)-2-[benzyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxy-3-p...
Create Date: 2006-10-27
CID: 11797375

4161. CHEMBL315043; SCHEMBL7346333; CGS 27023A Analog 52 ...
MW:     440.512060 g/mol MF: C23H24N2O5S
IUPAC name: 2-[benzyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxy-3-phenyl...
Create Date: 2006-10-27
CID: 11797374

4162. Bicalutamide Analogue, (R)-8; CHEMBL121783; BDBM18682 ...
MW:     437.458570 g/mol MF: C19H14F3N3O2S2
IUPAC name: (2R)-N-[4-cyano-3-(trifluoromethyl)phenyl]-2-hydroxy-3-(3-is...
Create Date: 2006-10-27
CID: 11797234

4163. Bicalutamide Analogue, (R)-5; CHEMBL340668; BDBM18679 ...
MW:     395.398750 g/mol MF: C18H16F3N3O2S
IUPAC name: (2R)-3-(4-aminophenyl)sulfanyl-N-[4-cyano-3-(trifluoromethyl...
Create Date: 2006-10-27
CID: 11794987

4164. BMCL16311 Compound 1b; CHEMBL306154; CGS 27023A Analog 71 ...
MW:     393.457320 g/mol MF: C18H23N3O5S
IUPAC name: (2S)-N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(pyridin-3-ylmet...
Create Date: 2006-10-27
CID: 11794888

4165. TG-0203770; CHEMBL212080; SCHEMBL8050493 ...
MW:     630.772100 g/mol MF: C33H50N4O8
IUPAC name: ethyl (E,4S)-4-[[(2S)-4-methyl-2-[[(2S)-3-[(2-methylpropan-2...
Create Date: 2006-10-26
CID: 11786957

4166. CHEMBL254041; SCHEMBL5673185; alpha-methyl amide analogue, 11 ...
MW:     565.164240 g/mol MF: C29H41ClN2O5S
IUPAC name: [2-[(4-tert-butylphenyl)methyl]-3-[2-[3-chloro-4-(methanesul...
Create Date: 2006-10-26
CID: 11786356

4167. CHEMBL108872; N-Alkylated Tacrine Analogue 3; BDBM10488 ...
MW:     342.885560 g/mol MF: C19H19ClN2S
IUPAC name: 1-chloro-N-(thiophen-2-ylmethyl)-7,8,9,10-tetrahydro-6H-cycl...
Create Date: 2006-10-26
CID: 11759669

4168. CHEMBL220117; SCHEMBL1400351; Indanylacetic Acid Analog, 34g ...
MW:     507.684080 g/mol MF: C30H37NO4S
IUPAC name: 2-[(1S)-5-[3-[4-(4-tert-butyl-1,3-thiazol-2-yl)-2-propylphen...
Create Date: 2006-10-26
CID: 11755968

4169. CHEMBL219688; SCHEMBL1400498; Indanylacetic Acid Analog, 17x ...
MW:     492.510630 g/mol MF: C24H23F3N2O4S
IUPAC name: 2-[(1S)-5-[3-[2-methyl-4-[3-(trifluoromethyl)-1,2,4-thiadiaz...
Create Date: 2006-10-26
CID: 11755396

4170. CHEMBL374925; SCHEMBL1400962; Indanylacetic Acid Analog, 34k ...
MW:     467.577160 g/mol MF: C26H29NO5S
IUPAC name: 2-[(1S)-5-[3-[4-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methoxyphe...
Create Date: 2006-10-26
CID: 11754345

4171. CHEMBL109105; BDBM10491; N-Alkylated Tacrine Analogue 6b ...
MW:     396.446490 g/mol MF: C21H27F3N2O2
IUPAC name: 1,1,1-trifluoro-7-(7,8,9,10-tetrahydro-6H-cyclohepta[b]quino...
Create Date: 2006-10-26
CID: 11732020

4172. CHEMBL137444; Substituted Benzene Analog 50d; BDBM14598 ...
MW:     492.611380 g/mol MF: C31H32N4O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[2-methoxy-6-phenyl-3-(2...
Create Date: 2006-10-26
CID: 11730709

4173. CHEMBL200927; SCHEMBL4143820; Pyrrolidine Isatin Analogue 11f ...
MW:     492.543560 g/mol MF: C26H24N2O6S
IUPAC name: 1-[(4-hydroxyphenyl)methyl]-5-[(2S)-2-(phenoxymethyl)pyrroli...
Create Date: 2006-10-26
CID: 11712912

4174. Morpholino-ethyl analogue, 34; CHEMBL271837; SCHEMBL2075764 ...
MW:     370.485200 g/mol MF: C22H30N2O3
IUPAC name: [6-hydroxy-1-(2-morpholin-4-ylethyl)indol-3-yl]-(2,2,3,3-tet...
Create Date: 2006-10-26
CID: 11696383

4175. Morpholino-ethyl analogue, 36; CHEMBL409265; SCHEMBL2075945 ...
MW:     384.511780 g/mol MF: C23H32N2O3
IUPAC name: [6-methoxy-1-(2-morpholin-4-ylethyl)indol-3-yl]-(2,2,3,3-tet...
Create Date: 2006-10-26
CID: 11689539

4176. (S)-1-(4-methoxybenzyl)-5-(2-phenoxymethyl-azetidine-1-sulfonyl)-1H-indole-2,3-dione; Azetidine Isatin Analogue 18c; CHEMBL200813 ...
MW:     492.543560 g/mol MF: C26H24N2O6S
IUPAC name: 1-[(4-methoxyphenyl)methyl]-5-[(2S)-2-(phenoxymethyl)azetidi...
Create Date: 2006-10-26
CID: 11684618

4177. Morpholino-ethyl analogue, 38; CHEMBL411937; SCHEMBL2078813 ...
MW:     460.607740 g/mol MF: C29H36N2O3
IUPAC name: [1-(2-morpholin-4-ylethyl)-6-phenylmethoxyindol-3-yl]-(2,2,3...
Create Date: 2006-10-26
CID: 11676975

4178. 8-benzyladenine analogue, 12d; CHEMBL425578; SCHEMBL1965706 ...
MW:     437.278070 g/mol MF: C17H20IN5O
IUPAC name: 9-butyl-8-[(2-iodo-5-methoxyphenyl)methyl]purin-6-amine
Create Date: 2006-10-26
CID: 11676469

4179. CHEMBL195454; trifluoroethylamine analogue, 1; BDBM19518 ...
MW:     487.560390 g/mol MF: C26H32F3N5O
IUPAC name: (2S)-N-(cyanomethyl)-4-methyl-2-[[(1S)-2,2,2-trifluoro-1-[4-...
Create Date: 2006-10-26
CID: 11656060

4180. CHEMBL222333; SCHEMBL8997925; BDBM24611 ...
MW:     376.386983 g/mol MF: C20H17FN6O
IUPAC name: 1-ethyl-3-[4-(3-fluoropyridin-2-yl)-6-pyridin-3-yl-1H-benzim...
Create Date: 2006-10-26
CID: 11646514

4181. Morpholino-ethyl analogue, 39; CHEMBL270910; SCHEMBL2079343 ...
MW:     368.512380 g/mol MF: C23H32N2O2
IUPAC name: [2-methyl-1-(2-morpholin-4-ylethyl)indol-3-yl]-(2,2,3,3-tetr...
Create Date: 2006-10-26
CID: 11639250

4182. CHEMBL372994; SCHEMBL4140312; Pyrrolidine Isatin Analogue 11i ...
MW:     495.522683 g/mol MF: C25H22FN3O5S
IUPAC name: 1-[(6-fluoropyridin-2-yl)methyl]-5-[(2S)-2-(phenoxymethyl)py...
Create Date: 2006-10-26
CID: 11634649

4183. (S)-1-(2-fluorobenzyl)-5-(2-phenoxymethyl-azetidine-1-sulfonyl)-1H-indole-2,3-dione; Azetidine Isatin Analogue 18f; CHEMBL200493 ...
MW:     480.508043 g/mol MF: C25H21FN2O5S
IUPAC name: 1-[(2-fluorophenyl)methyl]-5-[(2S)-2-(phenoxymethyl)azetidin...
Create Date: 2006-10-26
CID: 11634372

4184. CHEMBL222348; SCHEMBL14097531; BDBM24613 ...
MW:     342.352520 g/mol MF: C16H18N6O3
IUPAC name: 1-ethyl-3-[5-methoxy-6-(2-methoxypyrimidin-5-yl)-1H-benzimid...
Create Date: 2006-10-26
CID: 11624303

4185. Azetidine Isatin Analogue 18g; CHEMBL370012; SCHEMBL4152385 ...
MW:     481.496103 g/mol MF: C24H20FN3O5S
IUPAC name: 1-[(6-fluoropyridin-3-yl)methyl]-5-[(2S)-2-(phenoxymethyl)az...
Create Date: 2006-10-26
CID: 11619968

4186. 895155-26-7; (1-(2-morpholinoethyl)-1H-indol-3-yl)(2,2,3,3-tetramethylcyclopropyl)methanone; A-796260 ...
MW:     354.485800 g/mol MF: C22H30N2O2
IUPAC name: [1-(2-morpholin-4-ylethyl)indol-3-yl]-(2,2,3,3-tetramethylcy...
Create Date: 2006-10-26
CID: 11584525

4187. CHEMBL373012; SCHEMBL4143079; Pyrrolidine Isatin Analogue 11h ...
MW:     495.522683 g/mol MF: C25H22FN3O5S
IUPAC name: 1-[(2-fluoropyridin-4-yl)methyl]-5-[(2S)-2-(phenoxymethyl)py...
Create Date: 2006-10-26
CID: 11584106

4188. (S)-1-(4-fluorobenzyl)-5-(2-phenoxymethyl-azetidine-1-sulfonyl)-1H-indole-2,3-dione; Azetidine Isatin Analogue 18e; CHEMBL200886 ...
MW:     480.508043 g/mol MF: C25H21FN2O5S
IUPAC name: 1-[(4-fluorophenyl)methyl]-5-[(2S)-2-(phenoxymethyl)azetidin...
Create Date: 2006-10-26
CID: 11583840

4189. 8-benzyladenine analogue, 12b; CHEMBL199865; SCHEMBL5521691 ...
MW:     345.826600 g/mol MF: C17H20ClN5O
IUPAC name: 9-butyl-8-[(2-chloro-5-methoxyphenyl)methyl]purin-6-amine
Create Date: 2006-10-26
CID: 11581013

4190. CHEMBL372607; (S)-1-(4-fluorobenzyl)-5-(2-phenoxymethyl-pyrrolidine-1-sulfonyl)-1H-indole-2,3-dione; SCHEMBL2260281 ...
MW:     494.534623 g/mol MF: C26H23FN2O5S
IUPAC name: 1-[(4-fluorophenyl)methyl]-5-[(2S)-2-(phenoxymethyl)pyrrolid...
Create Date: 2006-10-26
CID: 11576852

4191. Azetidine Isatin Analogue 18h; CHEMBL196855; SCHEMBL4158993 ...
MW:     481.496103 g/mol MF: C24H20FN3O5S
IUPAC name: 1-[(2-fluoropyridin-4-yl)methyl]-5-[(2S)-2-(phenoxymethyl)az...
Create Date: 2006-10-26
CID: 11576622

4192. CHEMBL382125; SCHEMBL1964645; 8-sulfanyladenine analogue, 18 ...
MW:     359.445940 g/mol MF: C17H21N5O2S
IUPAC name: 9-butyl-8-(2,5-dimethoxyphenyl)sulfanylpurin-6-amine
Create Date: 2006-10-26
CID: 11574041

4193. 8-benzyladenine analogue, 12c; CHEMBL201772; SCHEMBL1963379 ...
MW:     390.277600 g/mol MF: C17H20BrN5O
IUPAC name: 8-[(2-bromo-5-methoxyphenyl)methyl]-9-butylpurin-6-amine
Create Date: 2006-10-26
CID: 11567291

4194. CHEMBL372956; BAY 59-7939 Analog 8; BDBM12992 ...
MW:     423.888863 g/mol MF: C19H19ClFN3O3S
IUPAC name: 5-chloro-N-[[(5S)-3-(3-fluoro-4-pyrrolidin-1-ylphenyl)-2-oxo...
Create Date: 2006-10-26
CID: 11553603

4195. Morpholino-ethyl analogue, 41; CHEMBL271814; SCHEMBL2077998 ...
MW:     369.500440 g/mol MF: C22H31N3O2
IUPAC name: [4-amino-1-(2-morpholin-4-ylethyl)indol-3-yl]-(2,2,3,3-tetra...
Create Date: 2006-10-26
CID: 11552423

4196. CHEMBL200653; SCHEMBL4156239; Pyrrolidine Isatin Analogue 11g ...
MW:     495.522683 g/mol MF: C25H22FN3O5S
IUPAC name: 1-[(6-fluoropyridin-3-yl)methyl]-5-[(2S)-2-(phenoxymethyl)py...
Create Date: 2006-10-26
CID: 11533326

4197. Azetidine Isatin Analogue 18i; CHEMBL371687; SCHEMBL4152413 ...
MW:     481.496103 g/mol MF: C24H20FN3O5S
IUPAC name: 1-[(6-fluoropyridin-2-yl)methyl]-5-[(2S)-2-(phenoxymethyl)az...
Create Date: 2006-10-26
CID: 11525874

4198. 5-Chloro-N-({(5S)-3-[4-(dimethylamino)phenyl]-2-oxo-1,3-oxazolidin-5-yl}methyl)thiophene-2-carboxamide; 5-chloro-N-{[(5S)-3-[4-(dimethylamino)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl}thiophene-2-carboxamide; SCHEMBL87217 ...
MW:     379.861120 g/mol MF: C17H18ClN3O3S
IUPAC name: 5-chloro-N-[[(5S)-3-[4-(dimethylamino)phenyl]-2-oxo-1,3-oxaz...
Create Date: 2006-10-26
CID: 11523750

4199. LY2066948 analogue, 9; CHEMBL1196715; BDBM19965 ...
MW:     515.663020 g/mol MF: C31H33NO4S
IUPAC name: 6-(4-methylsulfonylphenyl)-5-[[4-(2-piperidin-1-ylethoxy)phe...
Create Date: 2006-10-26
CID: 11519654

4200. (S)-1-(4-methylthiobenzyl)-5-(2-phenoxymethyl-pyrrolidine-1-sulfonyl)-1H-indole-2,3-dione; CHEMBL200220; SCHEMBL4154263 ...
MW:     522.635740 g/mol MF: C27H26N2O5S2
IUPAC name: 1-[(4-methylsulfanylphenyl)methyl]-5-[(2S)-2-(phenoxymethyl)...
Create Date: 2006-10-26
CID: 11519268

4201. CHEMBL200476; Pyrrolidine Isatin Analogue 11e; BDBM10333 ...
MW:     534.580240 g/mol MF: C28H26N2O7S
IUPAC name: [4-[[2,3-dioxo-5-[(2S)-2-(phenoxymethyl)pyrrolidin-1-yl]sulf...
Create Date: 2006-10-26
CID: 11512139

4202. (S)-1-methyl-5-(2-phenoxymethyl-azetidine-1-sulfonyl)-1H-indole-2,3-dione; Azetidine Isatin Analogue 18a; CHEMBL371709 ...
MW:     386.421620 g/mol MF: C19H18N2O5S
IUPAC name: 1-methyl-5-[(2S)-2-(phenoxymethyl)azetidin-1-yl]sulfonylindo...
Create Date: 2006-10-26
CID: 11509289

4203. (S)-1-(4-methylthiobenzyl)-5-(2-phenoxymethyl-azetidine-1-sulfonyl)-1H-indole-2,3-dione; Azetidine Isatin Analogue 18d; CHEMBL382084 ...
MW:     508.609160 g/mol MF: C26H24N2O5S2
IUPAC name: 1-[(4-methylsulfanylphenyl)methyl]-5-[(2S)-2-(phenoxymethyl)...
Create Date: 2006-10-26
CID: 11497112

4204. (S)-1-benzyl-5-(2-phenoxymethyl-azetidine-1-sulfonyl)-1H-indole-2,3-dione; Azetidine Isatin Analogue 18b; CHEMBL200785 ...
MW:     462.517580 g/mol MF: C25H22N2O5S
IUPAC name: 1-benzyl-5-[(2S)-2-(phenoxymethyl)azetidin-1-yl]sulfonylindo...
Create Date: 2006-10-26
CID: 11496333

4205. Morpholino-ethyl analogue, 40; CHEMBL411888; SCHEMBL2078457 ...
MW:     399.483360 g/mol MF: C22H29N3O4
IUPAC name: [1-(2-morpholin-4-ylethyl)-4-nitroindol-3-yl]-(2,2,3,3-tetra...
Create Date: 2006-10-26
CID: 11495004

4206. CHEMBL400674; SCHEMBL5673106; alpha-methyl amide analogue, 15 ...
MW:     537.111080 g/mol MF: C27H37ClN2O5S
IUPAC name: [2-[[2-[3-chloro-4-(methanesulfonamido)phenyl]propanoylamino...
Create Date: 2006-10-26
CID: 11489538

4207. CHEMBL213543; SCHEMBL8050594; TG-0205221 Analogue 3 ...
MW:     572.692960 g/mol MF: C30H44N4O7
IUPAC name: ethyl (E,4S)-4-[[(2S)-4-methyl-2-[[(2S)-3-methyl-2-(phenylme...
Create Date: 2006-10-26
CID: 11444522

4208. CHEMBL254247; SCHEMBL5674804; alpha-methyl amide analogue, 14 ...
MW:     520.656483 g/mol MF: C27H37FN2O5S
IUPAC name: [2-[(3,4-dimethylphenyl)methyl]-3-[2-[3-fluoro-4-(methanesul...
Create Date: 2006-10-26
CID: 11443800

4209. CHEMBL479370; Triazolopiperazine Analogue 26; BDBM11161 ...
MW:     339.315650 g/mol MF: C15H16F3N5O
IUPAC name: (3R)-3-amino-1-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin...
Create Date: 2006-10-26
CID: 11441300

4210. CHEMBL487663; SCHEMBL1360691; BDBM24609 ...
MW:     358.396520 g/mol MF: C20H18N6O
IUPAC name: 1-ethyl-3-(4-pyridin-2-yl-6-pyridin-3-yl-1H-benzimidazol-2-y...
Create Date: 2006-10-26
CID: 11428309

4211. alpha-ketothiazole analogue 37; CHEMBL264357; SCHEMBL8312293 ...
MW:     714.676200 g/mol MF: C31H40BrN9O4S
IUPAC name: (2S)-2-[[(2S)-2-[[(1R)-1-(4-bromophenyl)ethyl]carbamoylamino...
Create Date: 2006-10-26
CID: 11399867

4212. CHEMBL486831; SCHEMBL8997099; BDBM24614 ...
MW:     348.361940 g/mol MF: C17H16N8O
IUPAC name: 1-ethyl-3-(4-pyrazol-1-yl-6-pyrimidin-5-yl-1H-benzimidazol-2...
Create Date: 2006-10-26
CID: 11393909

4213. CHEMBL443486; SCHEMBL5020207; 1,2,3-triazole analogue, 25 ...
MW:     185.182080 g/mol MF: C10H7N3O
IUPAC name: 4-(1-benzofuran-2-yl)-2H-triazole
Create Date: 2006-10-26
CID: 11389807

4214. CHEMBL254454; SCHEMBL5673505; alpha-methyl amide analogue, 16 ...
MW:     532.692000 g/mol MF: C28H40N2O6S
IUPAC name: [2-[(3,4-dimethylphenyl)methyl]-3-[2-[4-(methanesulfonamido)...
Create Date: 2006-10-26
CID: 11387042

4215. alpha-methyl amide analogue, 9; CHEMBL253393; SCHEMBL5674835 ...
MW:     530.719180 g/mol MF: C29H42N2O5S
IUPAC name: [2-[(4-tert-butylphenyl)methyl]-3-[2-[4-(methanesulfonamido)...
Create Date: 2006-10-26
CID: 11387011

4216. diastereomeric mixture; CHEMBL445412; SCHEMBL5676745 ...
MW:     548.709643 g/mol MF: C29H41FN2O5S
IUPAC name: [2-[(4-tert-butylphenyl)methyl]-3-[2-[3-fluoro-4-(methanesul...
Create Date: 2006-10-26
CID: 11364848

4217. CHEMBL254246; SCHEMBL5673780; alpha-methyl amide analogue, 13 ...
MW:     502.666020 g/mol MF: C27H38N2O5S
IUPAC name: [2-[(3,4-dimethylphenyl)methyl]-3-[2-[4-(methanesulfonamido)...
Create Date: 2006-10-26
CID: 11364108

4218. CHEMBL487852; SCHEMBL1358290; BDBM24608 ...
MW:     347.373880 g/mol MF: C18H17N7O
IUPAC name: 1-ethyl-3-(4-pyrazol-1-yl-6-pyridin-3-yl-1H-benzimidazol-2-y...
Create Date: 2006-10-26
CID: 11314018

4219. CHEMBL517072; Triazolopiperazine Analogue 27; BDBM11163 ...
MW:     457.321126 g/mol MF: C17H15F8N5O
IUPAC name: (3R)-3-amino-1-[3-(1,1,2,2,2-pentafluoroethyl)-6,8-dihydro-5...
Create Date: 2006-10-26
CID: 11306468

4220. alpha-ketothiazole analogue 15; CHEMBL266570; BDBM12955 ...
MW:     655.639400 g/mol MF: C28H40Cl2N8O4S
IUPAC name: (2S)-N-[(2S)-1-[[(2S)-5-(diaminomethylideneamino)-1-oxo-1-(1...
Create Date: 2006-10-26
CID: 11273795

4221. 4-t-butylbenzyl analogue, 73; CHEMBL399229; SCHEMBL5674726 ...
MW:     565.164240 g/mol MF: C29H41ClN2O5S
IUPAC name: [(2R)-2-[(4-tert-butylphenyl)methyl]-3-[[(2S)-2-[3-chloro-4-...
Create Date: 2006-10-26
CID: 11226817

4222. Carbocyclic Peptidomimetic; CHEMBL434943; OM99-2 cyclopentano analog 3 ...
MW:     919.029340 g/mol MF: C43H66N8O14
IUPAC name: (4S)-4-amino-5-[[(2S)-1-[[(2S)-4-amino-1-[[(1S,2S)-1-[(1R,2R...
Create Date: 2006-10-26
CID: 11205295

4223. CHEMBL400477; SCHEMBL5676226; alpha-methyl amide analogue, 12 ...
MW:     560.745160 g/mol MF: C30H44N2O6S
IUPAC name: [2-[(4-tert-butylphenyl)methyl]-3-[2-[4-(methanesulfonamido)...
Create Date: 2006-10-26
CID: 11203786

4224. CHEMBL380817; SCHEMBL5020148; 1,2,3-triazole analogue, 22 ...
MW:     271.057810 g/mol MF: C8H6IN3
IUPAC name: 4-(3-iodophenyl)-2H-triazole
Create Date: 2006-10-26
CID: 11173284

4225. sulfotyrosyl tripeptide analog 7; BDBM13612; 5-[(S)-2-[[(S)-2-[3-(Methoxycarbonyl)propionylamino]-3-phenylpropionyl]amino]-2-(pentylcarbamoyl)ethyl]-2-[(methoxycarbonyl)methoxy]benzoic acid methyl ester ...
MW:     641.708620 g/mol MF: C33H43N3O10
IUPAC name: methyl 5-[(2S)-2-[[(2S)-2-[(4-methoxy-4-oxobutanoyl)amino]-3...
Create Date: 2006-10-26
CID: 11125103

4226. CHEMBL333980; Substituted Benzene Analog 50e; BDBM14599 ...
MW:     430.542000 g/mol MF: C26H30N4O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[2-methoxy-6-phenyl-3-(p...
Create Date: 2006-10-26
CID: 11102065

4227. SCHEMBL6572474; sulfotyrosyl tripeptide analog 2; BDBM13607 ...
MW:     430.472640 g/mol MF: C18H26N2O8S
IUPAC name: 4-oxo-4-[[(2S)-1-oxo-1-(pentylamino)-3-(4-sulfooxyphenyl)pro...
Create Date: 2006-10-26
CID: 11102055

4228. SCHEMBL6572344; CHEMBL3219357; sulfotyrosyl tripeptide analog 3 ...
MW:     452.455020 g/mol MF: C21H28N2O9
IUPAC name: 2-[4-[(2S)-2-(3-carboxypropanoylamino)-3-oxo-3-(pentylamino)...
Create Date: 2006-10-26
CID: 11080905

4229. CHEMBL343173; Substituted Benzene Analog 50a; BDBM14595 ...
MW:     480.575863 g/mol MF: C30H29FN4O
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[2-fluoro-6-phenyl-3-(2-...
Create Date: 2006-10-26
CID: 11059896

4230. CHEMBL137483; Substituted Benzene Analog 29b; BDBM14603 ...
MW:     472.507586 g/mol MF: C23H22F2N4O3S
IUPAC name: 2-[3-(benzylsulfonylamino)-2,6-difluorophenyl]-N-[(4-carbami...
Create Date: 2006-10-26
CID: 11027118

4231. CHEMBL134792; Substituted Benzene Analog 30b; BDBM14594 ...
MW:     422.470366 g/mol MF: C24H24F2N4O
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[2,6-difluoro-3-(2-pheny...
Create Date: 2006-10-26
CID: 11015356

4232. SCHEMBL6574908; sulfotyrosyl tripeptide analog 4; BDBM13609 ...
MW:     599.628880 g/mol MF: C30H37N3O10
IUPAC name: 2-[4-[(2S)-2-[[(2S)-2-(3-carboxypropanoylamino)-3-phenylprop...
Create Date: 2006-10-26
CID: 10995585

4233. Substituted Benzene Analog 51; CHEMBL138119; BDBM14600 ...
MW:     478.584800 g/mol MF: C30H30N4O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[2-hydroxy-6-phenyl-3-(2...
Create Date: 2006-10-26
CID: 10994432

4234. CHEMBL107504; BDBM10490; N-Alkylated Tacrine Analogue 6a ...
MW:     430.891550 g/mol MF: C21H26ClF3N2O2
IUPAC name: 7-[(1-chloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11...
Create Date: 2006-10-26
CID: 10950066

4235. CHEMBL322994; N-Alkylated Tacrine Analogue 4; BDBM10489 ...
MW:     438.893630 g/mol MF: C21H18ClF3N2OS
IUPAC name: 1-[5-[[(1-chloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoli...
Create Date: 2006-10-26
CID: 10906285

4236. CHEMBL125585; Substituted Benzene Analog 53; BDBM14601 ...
MW:     416.515420 g/mol MF: C25H28N4O2
IUPAC name: N-[(4-carbamimidoylphenyl)methyl]-2-[2-hydroxy-6-phenyl-3-(p...
Create Date: 2006-10-26
CID: 10905809

4237. CHEMBL314369; SCHEMBL7350511; CGS 27023A Analog 34 ...
MW:     426.485480 g/mol MF: C22H22N2O5S
IUPAC name: N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-[(4-phenylphenyl)meth...
Create Date: 2006-10-26
CID: 10836183

4238. CHEMBL311336; SCHEMBL7349423; CGS 27023A Analog 57 ...
MW:     392.469260 g/mol MF: C19H24N2O5S
IUPAC name: 2-[benzyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxy-3-methyl...
Create Date: 2006-10-26
CID: 10834357

4239. CHEMBL82869; SCHEMBL7341425; CGS 27023A Analog 21 ...
MW:     374.452440 g/mol MF: C16H26N2O6S
IUPAC name: 2-[[4-(2-ethoxyethoxy)phenyl]sulfonyl-(2-methylpropyl)amino]...
Create Date: 2006-10-26
CID: 10833242

4240. CHEMBL83091; SCHEMBL7346814; CGS 27023A Analog 38 ...
MW:     371.451800 g/mol MF: C16H25N3O5S
IUPAC name: N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(2-piperidin-1-ylethy...
Create Date: 2006-10-26
CID: 10833044

4241. CHEMBL315949; SCHEMBL7421418; CGS 27023A Analog 41 ...
MW:     351.377580 g/mol MF: C15H17N3O5S
IUPAC name: N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(pyridin-4-ylmethyl)a...
Create Date: 2006-10-26
CID: 10831751

4242. CHEMBL310347; SCHEMBL7347071; CGS 27023A Analog 10 ...
MW:     354.345290 g/mol MF: C13H17F3N2O4S
IUPAC name: N-hydroxy-2-[2-methylpropyl-[4-(trifluoromethyl)phenyl]sulfo...
Create Date: 2006-10-26
CID: 10808023

4243. CHEMBL420784; SCHEMBL6413655; CGS 27023A Analog 29 ...
MW:     342.410580 g/mol MF: C15H22N2O5S
IUPAC name: 2-[cyclohexyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxyaceta...
Create Date: 2006-10-26
CID: 10807240

4244. CHEMBL82855; CGS 27023A Analog 60; BDBM13128 ...
MW:     456.533060 g/mol MF: C19H24N2O7S2
IUPAC name: (2R)-2-[benzyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxy-4-m...
Create Date: 2006-10-26
CID: 10789971

4245. CHEMBL83685; SCHEMBL2680842; CGS 27023A Analog 54 ...
MW:     406.495840 g/mol MF: C20H26N2O5S
IUPAC name: (2R)-2-[benzyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxy-4-m...
Create Date: 2006-10-26
CID: 10787514

4246. CHEMBL84814; SCHEMBL7350900; CGS 27023A Analog 28 ...
MW:     370.463740 g/mol MF: C17H26N2O5S
IUPAC name: 2-[2-cyclohexylethyl-(4-methoxyphenyl)sulfonylamino]-N-hydro...
Create Date: 2006-10-26
CID: 10785400

4247. CHEMBL83864; SCHEMBL7341391; CGS 27023A Analog 16 ...
MW:     358.453040 g/mol MF: C16H26N2O5S
IUPAC name: 2-[(4-butoxyphenyl)sulfonyl-(2-methylpropyl)amino]-N-hydroxy...
Create Date: 2006-10-26
CID: 10784639

4248. CHEMBL312952; CGS 27023A Analog 63; BDBM13131
MW:     436.521820 g/mol MF: C21H28N2O6S
IUPAC name: (2R)-2-[benzyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxy-3-[...
Create Date: 2006-10-26
CID: 10765385

4249. Bicalutamide Analogue, (R)-6; CHEMBL424787; BDBM18680 ...
MW:     395.398750 g/mol MF: C18H16F3N3O2S
IUPAC name: (2R)-3-(3-aminophenyl)sulfanyl-N-[4-cyano-3-(trifluoromethyl...
Create Date: 2006-10-26
CID: 10763234

4250. CHEMBL315558; SCHEMBL7343330; CGS 27023A Analog 43 ...
MW:     351.377580 g/mol MF: C15H17N3O5S
IUPAC name: N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(pyridin-2-ylmethyl)a...
Create Date: 2006-10-26
CID: 10760373

4251. CHEMBL432572; CGS 27023A Analog 62; BDBM13130 ...
MW:     449.563640 g/mol MF: C22H31N3O5S
IUPAC name: (2R)-2-[benzyl-(4-methoxyphenyl)sulfonylamino]-6-(dimethylam...
Create Date: 2006-10-26
CID: 10742152

4252. CHEMBL312152; SCHEMBL7350806; CGS 27023A Analog 25 ...
MW:     392.469260 g/mol MF: C19H24N2O5S
IUPAC name: N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(4-phenylbutyl)amino]...
Create Date: 2006-10-26
CID: 10739270

4253. CHEMBL82047; SCHEMBL7350659; CGS 27023A Analog 18 ...
MW:     386.506200 g/mol MF: C18H30N2O5S
IUPAC name: 2-[(4-hexoxyphenyl)sulfonyl-(2-methylpropyl)amino]-N-hydroxy...
Create Date: 2006-10-26
CID: 10738924

4254. CHEMBL84598; SCHEMBL7352054; CGS 27023A Analog 24 ...
MW:     378.442680 g/mol MF: C18H22N2O5S
IUPAC name: N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(3-phenylpropyl)amino...
Create Date: 2006-10-26
CID: 10738429

4255. CHEMBL85108; SCHEMBL7350845; CGS 27023A Analog 37 ...
MW:     373.424620 g/mol MF: C15H23N3O6S
IUPAC name: N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(2-morpholin-4-ylethy...
Create Date: 2006-10-26
CID: 10738103

4256. CHEMBL85427; SCHEMBL6414220; CGS 27023A Analog 31 ...
MW:     316.373300 g/mol MF: C13H20N2O5S
IUPAC name: 2-[tert-butyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxyaceta...
Create Date: 2006-10-26
CID: 10734191

4257. CHEMBL125425; BDBM18689; Bicalutamide Analogue, (R)-15 ...
MW:     503.879290 g/mol MF: C20H17ClF3N3O5S
IUPAC name: (2R)-3-[4-[(2-chloroacetyl)amino]phenyl]sulfonyl-N-[4-cyano-...
Create Date: 2006-10-26
CID: 10720279

4258. Bicalutamide Analogue, (S)-7; CHEMBL178788; SCHEMBL16871150 ...
MW:     437.458570 g/mol MF: C19H14F3N3O2S2
IUPAC name: (2S)-N-[4-cyano-3-(trifluoromethyl)phenyl]-2-hydroxy-3-(4-is...
Create Date: 2006-10-26
CID: 10717833

4259. Bicalutamide Analogue, (S)-6; CHEMBL1744063; SCHEMBL16871590 ...
MW:     395.398750 g/mol MF: C18H16F3N3O2S
IUPAC name: (2S)-3-(3-aminophenyl)sulfanyl-N-[4-cyano-3-(trifluoromethyl...
Create Date: 2006-10-26
CID: 10715688

4260. Bicalutamide Analogue, (S)-5; CHEMBL341272; SCHEMBL16871541 ...
MW:     395.398750 g/mol MF: C18H16F3N3O2S
IUPAC name: (2S)-3-(4-aminophenyl)sulfanyl-N-[4-cyano-3-(trifluoromethyl...
Create Date: 2006-10-26
CID: 10715687

4261. CHEMBL84235; SCHEMBL7343987; CGS 27023A Analog 39 ...
MW:     380.415500 g/mol MF: C17H20N2O6S
IUPAC name: N-hydroxy-2-[(3-methoxyphenyl)methyl-(4-methoxyphenyl)sulfon...
Create Date: 2006-10-26
CID: 10714796

4262. CHEMBL283695; Topiramate Sulfamide Analogue 8; SCHEMBL13080537 ...
MW:     338.377280 g/mol MF: C12H22N2O7S
IUPAC name: (3aS,5aR,8aR,8bS)-2,2,7,7-tetramethyl-3a-[(sulfamoylamino)me...
Create Date: 2006-10-25
CID: 10712038

4263. CHEMBL125562; BDBM18688; Bicalutamide Analogue, (R)-14 ...
MW:     516.331490 g/mol MF: C20H17BrF3N3O3S
IUPAC name: (2R)-3-[3-[(2-bromoacetyl)amino]phenyl]sulfanyl-N-[4-cyano-3...
Create Date: 2006-10-25
CID: 10697187

4264. CHEMBL27907; BDBM22183; GBR 12935 Analogue, 12 ...
MW:     428.565880 g/mol MF: C28H32N2O2
IUPAC name: 3-[4-(2-benzhydryloxyethyl)piperazin-1-yl]-1-phenylpropan-1-...
Create Date: 2006-10-25
CID: 10693838

4265. CHEMBL84153; CGS 27023A Analog 59; BDBM13127 ...
MW:     424.534260 g/mol MF: C19H24N2O5S2
IUPAC name: (2R)-2-[benzyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxy-4-m...
Create Date: 2006-10-25
CID: 10693625

4266. CHEMBL85620; CGS 27023A Analog 67; BDBM13135 ...
MW:     406.495840 g/mol MF: C20H26N2O5S
IUPAC name: (2R)-2-[benzyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxy-3-m...
Create Date: 2006-10-25
CID: 10692726

4267. CHEMBL82783; SCHEMBL7348906; CGS 27023A Analog 33 ...
MW:     380.415500 g/mol MF: C17H20N2O6S
IUPAC name: N-hydroxy-2-[(4-methoxyphenyl)methyl-(4-methoxyphenyl)sulfon...
Create Date: 2006-10-25
CID: 10691191

4268. Calbiochem 444235; CHEMBL84594; SCHEMBL6420436 ...
MW:     316.373300 g/mol MF: C13H20N2O5S
IUPAC name: 2-[butan-2-yl-(4-methoxyphenyl)sulfonylamino]-N-hydroxyaceta...
Create Date: 2006-10-25
CID: 10686890

4269. CHEMBL314059; SCHEMBL7339188; CGS 27023A Analog 40 ...
MW:     440.467460 g/mol MF: C19H24N2O8S
IUPAC name: N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-[(3,4,5-trimethoxyphe...
Create Date: 2006-10-25
CID: 10670761

4270. Bicalutamide Analogue, (S)-8; CHEMBL442019; SCHEMBL16871261 ...
MW:     437.458570 g/mol MF: C19H14F3N3O2S2
IUPAC name: (2S)-N-[4-cyano-3-(trifluoromethyl)phenyl]-2-hydroxy-3-(3-is...
Create Date: 2006-10-25
CID: 10670612

4271. CHEMBL82232; SCHEMBL7346040; CGS 27023A Analog 17 ...
MW:     372.479620 g/mol MF: C17H28N2O5S
IUPAC name: N-hydroxy-2-[[4-(3-methylbutoxy)phenyl]sulfonyl-(2-methylpro...
Create Date: 2006-10-25
CID: 10667012

4272. CHEMBL82212; SCHEMBL7343449; CGS 27023A Analog 65 ...
MW:     420.522420 g/mol MF: C21H28N2O5S
IUPAC name: (2R)-2-[benzyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxy-4,4...
Create Date: 2006-10-25
CID: 10645799

4273. CHEMBL313836; CGS 27023A Analog 69; BDBM13137 ...
MW:     407.483900 g/mol MF: C19H25N3O5S
IUPAC name: (2R)-N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(pyridin-3-ylmet...
Create Date: 2006-10-25
CID: 10645086

4274. CHEMBL314204; CGS 27023A Analog 50; BDBM13118 ...
MW:     364.416100 g/mol MF: C17H20N2O5S
IUPAC name: (2S)-2-[benzyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxyprop...
Create Date: 2006-10-25
CID: 10642533

4275. CHEMBL86189; SCHEMBL6418821; CGS 27023A Analog 26 ...
MW:     330.399880 g/mol MF: C14H22N2O5S
IUPAC name: N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(3-methylbutyl)amino]...
Create Date: 2006-10-25
CID: 10640178

4276. CHEMBL125649; BDBM18687; Bicalutamide Analogue, (R)-13 ...
MW:     516.331490 g/mol MF: C20H17BrF3N3O3S
IUPAC name: (2R)-3-[4-[(2-bromoacetyl)amino]phenyl]sulfanyl-N-[4-cyano-3...
Create Date: 2006-10-25
CID: 10625685

4277. CHEMBL1744064; BDBM18686; Bicalutamide Analogue, (R)-12 ...
MW:     471.880490 g/mol MF: C20H17ClF3N3O3S
IUPAC name: (2R)-3-[3-[(2-chloroacetyl)amino]phenyl]sulfanyl-N-[4-cyano-...
Create Date: 2006-10-25
CID: 10624250

4278. CHEMBL84408; SCHEMBL7346383; CGS 27023A Analog 56 ...
MW:     406.495840 g/mol MF: C20H26N2O5S
IUPAC name: 2-[benzyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxy-3,3-dime...
Create Date: 2006-10-25
CID: 10621353

4279. CHEMBL314918; SCHEMBL6419046; CGS 27023A Analog 27 ...
MW:     356.437160 g/mol MF: C16H24N2O5S
IUPAC name: 2-[cyclohexylmethyl-(4-methoxyphenyl)sulfonylamino]-N-hydrox...
Create Date: 2006-10-25
CID: 10618255

4280. CHEMBL85319; CGS 27023A Analog 66; BDBM13134 ...
MW:     446.559700 g/mol MF: C23H30N2O5S
IUPAC name: (2R)-2-[benzyl-(4-methoxyphenyl)sulfonylamino]-3-cyclohexyl-...
Create Date: 2006-10-25
CID: 10599498

4281. CHEMBL314064; SCHEMBL7348032; CGS 27023A Analog 51 ...
MW:     364.416100 g/mol MF: C17H20N2O5S
IUPAC name: (2R)-2-[benzyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxyprop...
Create Date: 2006-10-25
CID: 10594938

4282. Hydroxamate 12; CHEMBL82868; SCHEMBL7338644 ...
MW:     350.389520 g/mol MF: C16H18N2O5S
IUPAC name: 2-[benzyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxyacetamide
Create Date: 2006-10-25
CID: 10594000

4283. CHEMBL84255; SCHEMBL7342151; CGS 27023A Analog 35 ...
MW:     342.291530 g/mol MF: C11H13F3N2O5S
IUPAC name: N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(2,2,2-trifluoroethyl...
Create Date: 2006-10-25
CID: 10593373

4284. CHEMBL82331; SCHEMBL6415304; CGS 27023A Analog 23 ...
MW:     364.416100 g/mol MF: C17H20N2O5S
IUPAC name: N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(2-phenylethyl)amino]...
Create Date: 2006-10-25
CID: 10570770

4285. CHEMBL315905; SCHEMBL7350210; CGS 27023A Analog 20 ...
MW:     344.426460 g/mol MF: C15H24N2O5S
IUPAC name: N-hydroxy-2-[2-methylpropyl-(4-propan-2-yloxyphenyl)sulfonyl...
Create Date: 2006-10-25
CID: 10569469

4286. CHEMBL121992; BDBM18690; Bicalutamide Analogue, (R)-16 ...
MW:     503.879290 g/mol MF: C20H17ClF3N3O5S
IUPAC name: (2R)-3-[3-[(2-chloroacetyl)amino]phenyl]sulfonyl-N-[4-cyano-...
Create Date: 2006-10-25
CID: 10553534

4287. CHEMBL333745; BDBM18685; Bicalutamide Analogue, (R)-11 ...
MW:     471.880490 g/mol MF: C20H17ClF3N3O3S
IUPAC name: (2R)-3-[4-[(2-chloroacetyl)amino]phenyl]sulfanyl-N-[4-cyano-...
Create Date: 2006-10-25
CID: 10552375

4288. CHEMBL432760; SCHEMBL7349366; CGS 27023A Analog 68 ...
MW:     463.547160 g/mol MF: C22H29N3O6S
IUPAC name: 2-[benzyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxy-4-morpho...
Create Date: 2006-10-25
CID: 10552056

4289. Acetamide,N-hydroxy-2-[[(4-methoxyphenyl)sulfonyl](3-pyridinylmethyl)amino]-; CHEMBL314596; SCHEMBL7340409 ...
MW:     351.377580 g/mol MF: C15H17N3O5S
IUPAC name: N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(pyridin-3-ylmethyl)a...
Create Date: 2006-10-25
CID: 10545870

4290. CHEMBL82759; CGS 27023A Analog 64; BDBM13132 ...
MW:     456.511460 g/mol MF: C23H24N2O6S
IUPAC name: 2-[benzyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxy-3-(4-hyd...
Create Date: 2006-10-25
CID: 10527787

4291. CHEMBL432385; CGS 27023A Analog 72; BDBM13140 ...
MW:     450.551700 g/mol MF: C21H30N4O5S
IUPAC name: (2R)-6-(dimethylamino)-N-hydroxy-2-[(4-methoxyphenyl)sulfony...
Create Date: 2006-10-25
CID: 10527557

4292. CHEMBL419491; SCHEMBL9176946; CGS 27023A Analog 73 ...
MW:     421.510480 g/mol MF: C20H27N3O5S
IUPAC name: (2R)-N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(pyridin-3-ylmet...
Create Date: 2006-10-25
CID: 10526209

4293. CHEMBL86113; SCHEMBL7346820; CGS 27023A Analog 19 ...
MW:     398.516900 g/mol MF: C19H30N2O5S
IUPAC name: 2-[[4-(cyclohexylmethoxy)phenyl]sulfonyl-(2-methylpropyl)ami...
Create Date: 2006-10-25
CID: 10524926

4294. CHEMBL360058; BDBM18691; Bicalutamide Analogue, (R)-17 ...
MW:     548.330290 g/mol MF: C20H17BrF3N3O5S
IUPAC name: (2R)-3-[4-[(2-bromoacetyl)amino]phenyl]sulfonyl-N-[4-cyano-3...
Create Date: 2006-10-25
CID: 10506812

4295. CHEMBL82827; SCHEMBL7342946; CGS 27023A Analog 55 ...
MW:     426.485480 g/mol MF: C22H22N2O5S
IUPAC name: (2R)-2-[benzyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxy-2-p...
Create Date: 2006-10-25
CID: 10502537

4296. CHEMBL220152; SCHEMBL1400686; BDBM21824 ...
MW:     497.603140 g/mol MF: C27H31NO6S
IUPAC name: 2-[(1S)-5-[3-[4-(4-ethoxy-5-methyl-1,3-thiazol-2-yl)-2-metho...
Create Date: 2006-10-25
CID: 10481007

4297. CHEMBL387350; SCHEMBL1400331; BDBM21819 ...
MW:     495.630320 g/mol MF: C28H33NO5S
IUPAC name: 2-[(1S)-5-[3-[4-(4-ethoxy-1,3-thiazol-2-yl)-2-propylphenoxy]...
Create Date: 2006-10-25
CID: 10480923

4298. CHEMBL378916; 5-amidinobenzimidazole analog 1; SCHEMBL12111058 ...
MW:     416.432600 g/mol MF: C22H20N6O3
IUPAC name: [3-[(5E)-5-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-yliden...
Create Date: 2006-10-25
CID: 10479047

4299. SCHEMBL1400467; CHEMBL2113263; Indanylacetic Acid Analog, 34p ...
MW:     505.668200 g/mol MF: C30H35NO4S
IUPAC name: 2-[(1S)-5-[3-[2-propyl-4-(4,5,6,7-tetrahydro-1,3-benzothiazo...
Create Date: 2006-10-25
CID: 10458842

4300. CHEMBL222248; SCHEMBL1400371; Indanylacetic Acid Analog, 34n ...
MW:     479.587860 g/mol MF: C27H29NO5S
IUPAC name: 2-[(1S)-5-[3-[4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-...
Create Date: 2006-10-25
CID: 10457843

4301. CHEMBL220224; SCHEMBL1400374; BDBM21816 ...
MW:     439.524000 g/mol MF: C24H25NO5S
IUPAC name: 2-[(1S)-5-[3-[4-(4-methoxy-1,3-thiazol-2-yl)phenoxy]propoxy]...
Create Date: 2006-10-25
CID: 10455871

4302. CHEMBL219686; SCHEMBL1400334; Indanylacetic Acid Analog, 17n ...
MW:     436.463990 g/mol MF: C24H27F3O4
IUPAC name: 2-[(1S)-5-[3-[2-propyl-4-(trifluoromethyl)phenoxy]propoxy]-2...
Create Date: 2006-10-25
CID: 10455681

4303. CHEMBL374682; SCHEMBL1400652; Indanylacetic Acid Analog, 34z ...
MW:     467.534100 g/mol MF: C25H25NO6S
IUPAC name: 2-[4-[3-[[(1S)-1-(carboxymethyl)-2,3-dihydro-1H-inden-5-yl]o...
Create Date: 2006-10-25
CID: 10434749

4304. CHEMBL519583; SCHEMBL12666897; BDBM24607 ...
MW:     338.363820 g/mol MF: C17H18N6O2
IUPAC name: 2-(ethylcarbamoylamino)-N-methyl-6-pyridin-3-yl-1H-benzimida...
Create Date: 2006-10-25
CID: 10427243

4305. CHEMBL219617; SCHEMBL1400681; Indanylacetic Acid Analog, 34q ...
MW:     493.614440 g/mol MF: C28H31NO5S
IUPAC name: 2-[(1S)-5-[3-[2-methoxy-4-(4,5,6,7-tetrahydro-1,3-benzothiaz...
Create Date: 2006-10-25
CID: 10368444

4306. CHEMBL220662; SCHEMBL1400162; Indanylacetic Acid Analog, 34x ...
MW:     536.682240 g/mol MF: C30H36N2O5S
IUPAC name: 2-[(1S)-5-[3-[4-[5-(dimethylcarbamoyl)-4-methyl-1,3-thiazol-...
Create Date: 2006-10-25
CID: 10347115

4307. CHEMBL219669; SCHEMBL1400978; BDBM21822 ...
MW:     497.603140 g/mol MF: C27H31NO6S
IUPAC name: 2-[(1S)-5-[3-[2-methoxy-4-(4-propan-2-yloxy-1,3-thiazol-2-yl...
Create Date: 2006-10-25
CID: 10323599

4308. CHEMBL220223; SCHEMBL3117156; Indanylacetic Acid Analog, 34m ...
MW:     491.641620 g/mol MF: C29H33NO4S
IUPAC name: 2-[(1S)-5-[3-[4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-...
Create Date: 2006-10-25
CID: 10323352

4309. CHEMBL208481; SCHEMBL2156945; BDBM19528 ...
MW:     439.421596 g/mol MF: C22H22F5N3O
IUPAC name: (2S)-N-(cyanomethyl)-2-[[(1S)-1-[4-(3,5-difluorophenyl)pheny...
Create Date: 2006-10-25
CID: 10288163

4310. CHEMBL205504; SCHEMBL2157417; BDBM19527 ...
MW:     439.421596 g/mol MF: C22H22F5N3O
IUPAC name: (2S)-N-(cyanomethyl)-2-[[(1S)-1-[4-(3,4-difluorophenyl)pheny...
Create Date: 2006-10-25
CID: 10288162

4311. BDBM9144; SCHEMBL14395247; P3 biaryl pyridylfuran analog 5 ...
MW:     721.765190 g/mol MF: C38H42F3N5O6
IUPAC name: (2S)-1-[(2S,4R)-4-benzyl-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4...
Create Date: 2006-10-25
CID: 10283706

4312. CHEMBL603633; SCHEMBL2970375; phenoxyacetic acid analogue, 19 ...
MW:     402.442480 g/mol MF: C24H22N2O4
IUPAC name: 2-[2-(2-naphthalen-2-ylethoxy)-4-(pyrazol-1-ylmethyl)phenoxy...
Create Date: 2006-10-25
CID: 10272453

4313. CHEMBL220557; SCHEMBL1400349; Indanylacetic Acid Analog, 34f ...
MW:     467.577160 g/mol MF: C26H29NO5S
IUPAC name: 2-[(1S)-5-[3-[4-(4-ethyl-1,3-thiazol-2-yl)-2-methoxyphenoxy]...
Create Date: 2006-10-25
CID: 10254028

4314. CHEMBL207554; SCHEMBL2155436; BDBM19533 ...
MW:     482.519110 g/mol MF: C22H25F3N4O3S
IUPAC name: (2S)-N-(cyanomethyl)-4-methyl-2-[[(1S)-2,2,2-trifluoro-1-[4-...
Create Date: 2006-10-25
CID: 10238903

4315. CHEMBL204277; SCHEMBL2156319; BDBM19522 ...
MW:     406.240770 g/mol MF: C16H19BrF3N3O
IUPAC name: (2S)-2-[[(1S)-1-(4-bromophenyl)-2,2,2-trifluoroethyl]amino]-...
Create Date: 2006-10-25
CID: 10237771

4316. CHEMBL137487; Substituted Benzene Analog 50b; BDBM14596 ...
MW:     481.563923 g/mol MF: C29H28FN5O
IUPAC name: 2-[6-(3-aminophenyl)-3-(benzylamino)-2-fluorophenyl]-N-[(4-c...
Create Date: 2006-10-25
CID: 10227730

4317. CHEMBL207769; SCHEMBL2155859; BDBM19525 ...
MW:     421.431133 g/mol MF: C22H23F4N3O
IUPAC name: (2S)-N-(cyanomethyl)-4-methyl-2-[[(1S)-2,2,2-trifluoro-1-[4-...
Create Date: 2006-10-25
CID: 10216511

4318. CHEMBL382576; SCHEMBL2157281; BDBM19524 ...
MW:     421.431133 g/mol MF: C22H23F4N3O
IUPAC name: (2S)-N-(cyanomethyl)-4-methyl-2-[[(1S)-2,2,2-trifluoro-1-[4-...
Create Date: 2006-10-25
CID: 10216510

4319. CHEMBL378583; SCHEMBL2156704; BDBM19541 ...
MW:     405.416790 g/mol MF: C20H22F3N5O
IUPAC name: (2S)-N-(cyanomethyl)-4-methyl-2-[[(1S)-2,2,2-trifluoro-1-(4-...
Create Date: 2006-10-25
CID: 10216231

4320. CHEMBL205929; SCHEMBL2157027; BDBM19526 ...
MW:     421.431133 g/mol MF: C22H23F4N3O
IUPAC name: (2S)-N-(cyanomethyl)-4-methyl-2-[[(1S)-2,2,2-trifluoro-1-[4-...
Create Date: 2006-10-25
CID: 10194634

4321. CHEMBL381758; SCHEMBL2157093; BDBM19539 ...
MW:     410.456450 g/mol MF: C19H21F3N4OS
IUPAC name: (2S)-N-(cyanomethyl)-4-methyl-2-[[(1S)-2,2,2-trifluoro-1-[4-...
Create Date: 2006-10-25
CID: 10194447

4322. CHEMBL206024; SCHEMBL2157064; BDBM19537 ...
MW:     404.428730 g/mol MF: C21H23F3N4O
IUPAC name: (2S)-N-(cyanomethyl)-4-methyl-2-[[(1S)-2,2,2-trifluoro-1-(4-...
Create Date: 2006-10-25
CID: 10194354

4323. CHEMBL437694; SCHEMBL2156992; BDBM19532 ...
MW:     449.532250 g/mol MF: C23H26F3N3OS
IUPAC name: (2S)-N-(cyanomethyl)-4-methyl-2-[[(1S)-2,2,2-trifluoro-1-[4-...
Create Date: 2006-10-25
CID: 10173731

4324. SCHEMBL77367; CHEMBL194810; BAY 59-7939 Analog 4 ...
MW:     455.953863 g/mol MF: C19H19ClFN3O3S2
IUPAC name: 5-chloro-N-[[(5S)-3-(3-fluoro-4-thiomorpholin-4-ylphenyl)-2-...
Create Date: 2006-10-25
CID: 10161422

4325. CHEMBL605833; SCHEMBL2970812; BDBM35861 ...
MW:     400.469660 g/mol MF: C25H24N2O3
IUPAC name: 3-[2-(2-naphthalen-2-ylethoxy)-4-(pyrazol-1-ylmethyl)phenyl]...
Create Date: 2006-10-25
CID: 10157813

4326. CHEMBL242813; Triazolopiperazine Analogue 24; SCHEMBL2667453 ...
MW:     389.323156 g/mol MF: C16H16F5N5O
IUPAC name: (3R)-3-amino-4-(3,4-difluorophenyl)-1-[3-(trifluoromethyl)-6...
Create Date: 2006-10-25
CID: 10157141

4327. CHEMBL381621; SCHEMBL2156924; BDBM19538 ...
MW:     409.468390 g/mol MF: C20H22F3N3OS
IUPAC name: (2S)-N-(cyanomethyl)-4-methyl-2-[[(1S)-2,2,2-trifluoro-1-(4-...
Create Date: 2006-10-25
CID: 10150891

4328. BDBM9143; CHEMBL114756; P3 biaryl pyridylfuran analog 4 ...
MW:     721.765190 g/mol MF: C38H42F3N5O6
IUPAC name: (2S)-1-[(2S,4R)-4-benzyl-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4...
Create Date: 2006-10-25
CID: 10146899

4329. Aminobenzisoxazole 2g; CHEMBL381949; BDBM12688 ...
MW:     538.496193 g/mol MF: C27H22F4N6O2
IUPAC name: 2-(3-amino-1,2-benzoxazol-5-yl)-N-[4-[2-[(dimethylamino)meth...
Create Date: 2006-10-25
CID: 10143532

4330. SCHEMBL77206; CHEMBL196162; BAY 59-7939 Analog 6 ...
MW:     439.888263 g/mol MF: C19H19ClFN3O4S
IUPAC name: 5-chloro-N-[[(5S)-3-(3-fluoro-4-morpholin-4-ylphenyl)-2-oxo-...
Create Date: 2006-10-25
CID: 10138114

4331. Triazolopiperazine Analogue 23; SCHEMBL1071184; CHEMBL1188964 ...
MW:     349.378346 g/mol MF: C17H21F2N5O
IUPAC name: (3R)-3-amino-4-(3,4-difluorophenyl)-1-(3-ethyl-6,8-dihydro-5...
Create Date: 2006-10-25
CID: 10132535

4332. CHEMBL380425; SCHEMBL2155650; BDBM19531 ...
MW:     428.450130 g/mol MF: C23H23F3N4O
IUPAC name: (2S)-N-(cyanomethyl)-2-[[(1S)-1-[4-(4-cyanophenyl)phenyl]-2,...
Create Date: 2006-10-25
CID: 10127183

4333. BDBM9145; SCHEMBL5258398; P3 biaryl pyridylfuran analog 6 ...
MW:     721.765190 g/mol MF: C38H42F3N5O6
IUPAC name: (2S)-1-[(2S,4R)-4-benzyl-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4...
Create Date: 2006-10-25
CID: 10122981

4334. CHEMBL374090; SCHEMBL1400786; Indanylacetic Acid Analog, 34h ...
MW:     519.575730 g/mol MF: C27H28F3NO4S
IUPAC name: 2-[(1S)-5-[3-[2-propyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-...
Create Date: 2006-10-25
CID: 10075336

4335. CHEMBL373791; SCHEMBL1400704; BDBM21823 ...
MW:     509.656900 g/mol MF: C29H35NO5S
IUPAC name: 2-[(1S)-5-[3-[4-(4-ethoxy-5-methyl-1,3-thiazol-2-yl)-2-propy...
Create Date: 2006-10-25
CID: 10075041

4336. CHEMBL222247; SCHEMBL1400267; BDBM21812 ...
MW:     509.613840 g/mol MF: C28H31NO6S
IUPAC name: 2-[4-[3-[[(1S)-1-(carboxymethyl)-2,3-dihydro-1H-inden-5-yl]o...
Create Date: 2006-10-25
CID: 10075037

4337. CHEMBL219668; SCHEMBL1400300; Indanylacetic Acid Analog, 34v ...
MW:     507.641020 g/mol MF: C29H33NO5S
IUPAC name: 2-[(1S)-5-[3-[4-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-propy...
Create Date: 2006-10-25
CID: 10074964

4338. CHEMBL220151; SCHEMBL1400676; Indanylacetic Acid Analog, 34w ...
MW:     495.587260 g/mol MF: C27H29NO6S
IUPAC name: 2-[(1S)-5-[3-[4-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-metho...
Create Date: 2006-10-25
CID: 10074505

4339. 2cmb; IZD 4; SCHEMBL5893505 ...
MW:     691.730760 g/mol MF: C32H29N5O9S2
IUPAC name: (2S)-N-[(2S)-1-amino-1-oxo-3-[4-(1,1,3-trioxo-1,2-thiazol-5-...
Create Date: 2006-10-25
CID: 10062719

4340. CHEMBL217311; SCHEMBL10226953; BDBM12307 ...
MW:     505.650120 g/mol MF: C26H43N5O5
IUPAC name: (1R,2S,5S)-N-(4-amino-1-cyclobutyl-3,4-dioxobutan-2-yl)-3-[(...
Create Date: 2006-10-25
CID: 10029184

4341. SCHEMBL10226941; BDBM12305; SCH 503034 Analogue 64 ...
MW:     534.688040 g/mol MF: C28H46N4O6
IUPAC name: [(2R)-3-methylbutan-2-yl] N-[(2S)-1-[(1R,2S,5S)-2-[(4-amino-...
Create Date: 2006-10-25
CID: 10007309

4342. CHEMBL424939; SCHEMBL1400421; Indanylacetic Acid Analog, 34t ...
MW:     489.582680 g/mol MF: C28H27NO5S
IUPAC name: 2-[(1S)-5-[3-[4-(1,3-benzothiazol-2-yl)-2-methoxyphenoxy]pro...
Create Date: 2006-10-25
CID: 10005763

4343. CHEMBL220836; SCHEMBL1400679; Indanylacetic Acid Analog, 17p ...
MW:     460.561380 g/mol MF: C29H32O5
IUPAC name: 2-[(1S)-5-[3-(4-phenoxy-2-propylphenoxy)propoxy]-2,3-dihydro...
Create Date: 2006-10-25
CID: 10004438

4344. CHEMBL220837; SCHEMBL1400266; Indanylacetic Acid Analog, 34j ...
MW:     437.551180 g/mol MF: C25H27NO4S
IUPAC name: 2-[(1S)-5-[3-[4-(4,5-dimethyl-1,3-thiazol-2-yl)phenoxy]propo...
Create Date: 2006-10-25
CID: 10003213

4345. CHEMBL220894; SCHEMBL1400468; BDBM21820 ...
MW:     483.576560 g/mol MF: C26H29NO6S
IUPAC name: 2-[(1S)-5-[3-[4-(4-ethoxy-1,3-thiazol-2-yl)-2-methoxyphenoxy...
Create Date: 2006-10-25
CID: 9982759

4346. Triazolopiperazine Analogue 22; SCHEMBL8364641; CHEMBL1188879 ...
MW:     321.325186 g/mol MF: C15H17F2N5O
IUPAC name: (3R)-3-amino-4-(3,4-difluorophenyl)-1-(6,8-dihydro-5H-[1,2,4...
Create Date: 2006-10-25
CID: 9966883

4347. Pyridine, 4-methyl-2-(1H-1,2,3-triazol-5-yl)-; 369363-66-6; CHEMBL194799 ...
MW:     160.175920 g/mol MF: C8H8N4
IUPAC name: 4-methyl-2-(2H-triazol-4-yl)pyridine
Create Date: 2006-10-25
CID: 9964177

4348. CHEMBL371166; SCHEMBL5020175; 1,2,3-triazole analogue, 32 ...
MW:     160.175920 g/mol MF: C8H8N4
IUPAC name: 2-methyl-6-(2H-triazol-4-yl)pyridine
Create Date: 2006-10-25
CID: 9964176

4349. CHEMBL123673; SCHEMBL16871141; BDBM18697 ...
MW:     471.880490 g/mol MF: C20H17ClF3N3O3S
IUPAC name: (2S)-3-[4-[(2-chloroacetyl)amino]phenyl]sulfanyl-N-[4-cyano-...
Create Date: 2006-10-25
CID: 9956430

4350. Bicalutamide Analogue, (R)-7; CHEMBL1744065; BDBM18681 ...
MW:     437.458570 g/mol MF: C19H14F3N3O2S2
IUPAC name: (2R)-N-[4-cyano-3-(trifluoromethyl)phenyl]-2-hydroxy-3-(4-is...
Create Date: 2006-10-25
CID: 9954749

4351. CHEMBL200884; phenyl-containing analogue, 14; SCHEMBL5525339 ...
MW:     313.394120 g/mol MF: C18H23N3O2
IUPAC name: N-[(2S)-1-(cyanomethylamino)-3-cyclohexyl-1-oxopropan-2-yl]b...
Create Date: 2006-10-25
CID: 9948720

4352. CHEMBL194520; SCHEMBL5020173; 1,2,3-triazole analogue, 31 ...
MW:     160.175920 g/mol MF: C8H8N4
IUPAC name: 5-methyl-2-(2H-triazol-4-yl)pyridine
Create Date: 2006-10-25
CID: 9942221

4353. 4-(1H-1,2,3-triazol-5-yl)pyridine; 4-(1H-1,2,3-triazol-4-yl)pyridine; 369363-76-8 ...
MW:     146.149340 g/mol MF: C7H6N4
IUPAC name: 4-(2H-triazol-4-yl)pyridine
Create Date: 2006-10-25
CID: 9942176

4354. Bicalutamide Analogue, (R)-9; CHEMBL178599; BDBM18683 ...
MW:     469.457370 g/mol MF: C19H14F3N3O4S2
IUPAC name: (2R)-N-[4-cyano-3-(trifluoromethyl)phenyl]-2-hydroxy-3-(4-is...
Create Date: 2006-10-25
CID: 9934361

4355. CHEMBL196532; SCHEMBL5020153; 1,2,3-triazole analogue, 12 ...
MW:     187.241020 g/mol MF: C11H13N3
IUPAC name: 4-(4-propylphenyl)-2H-triazole
Create Date: 2006-10-25
CID: 9920578

4356. CHEMBL200677; (S)-1-(4-methoxybenzyl)-5-(2-phenoxymethyl-pyrrolidine-1-sulfonyl)-1H-indole-2,3-dione; SCHEMBL4152857 ...
MW:     506.570140 g/mol MF: C27H26N2O6S
IUPAC name: 1-[(4-methoxyphenyl)methyl]-5-[(2S)-2-(phenoxymethyl)pyrroli...
Create Date: 2006-10-25
CID: 9914167

4357. Indanylacetic Acid Analog, 9b; CHEMBL220204; SCHEMBL1400580 ...
MW:     423.501460 g/mol MF: C25H29NO5
IUPAC name: 2-[(1S)-5-[3-[(3-methyl-7-propyl-1,2-benzoxazol-6-yl)oxy]pro...
Create Date: 2006-10-25
CID: 9910188

4358. CHEMBL194944; SCHEMBL5612902; SCHEMBL8780980 ...
MW:     221.257240 g/mol MF: C14H11N3
IUPAC name: 4-(2-phenylphenyl)-2H-triazole
Create Date: 2006-10-25
CID: 9877859

4359. 4-(2-methoxyphenyl)-1h-1,2,3-triazole; 369363-77-9; 1,2,3-triazole analogue, 9 ...
MW:     175.187260 g/mol MF: C9H9N3O
IUPAC name: 4-(2-methoxyphenyl)-2H-triazole
Create Date: 2006-10-25
CID: 9877511

4360. CHEMBL371119; SCHEMBL5020209; 1,2,3-triazole analogue, 29 ...
MW:     160.175920 g/mol MF: C8H8N4
IUPAC name: 3-methyl-2-(2H-triazol-4-yl)pyridine
Create Date: 2006-10-25
CID: 9877457

4361. BDBM9142; SCHEMBL5256384; P3 biaryl pyridylfuran analog 3 ...
MW:     749.818350 g/mol MF: C40H46F3N5O6
IUPAC name: (2S)-1-[(2S,4R)-4-benzyl-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4...
Create Date: 2006-10-25
CID: 9875352

4362. CHEMBL433754; BDBM18684; Bicalutamide Analogue, (R)-10 ...
MW:     469.457370 g/mol MF: C19H14F3N3O4S2
IUPAC name: (2R)-N-[4-cyano-3-(trifluoromethyl)phenyl]-2-hydroxy-3-(3-is...
Create Date: 2006-10-25
CID: 9869286

4363. CHEMBL125781; Substituted Benzene Analog 50c; BDBM14597 ...
MW:     433.521123 g/mol MF: C25H28FN5O
IUPAC name: 2-[6-(3-aminophenyl)-2-fluoro-3-(propan-2-ylamino)phenyl]-N-...
Create Date: 2006-10-25
CID: 9845742

4364. CHEMBL486832; SCHEMBL8997109; BDBM24615 ...
MW:     419.439840 g/mol MF: C20H21N9O2
IUPAC name: N-cyclopropyl-1-[2-(ethylcarbamoylamino)-7-pyrazol-1-yl-3H-b...
Create Date: 2006-10-25
CID: 9844989

4365. CHEMBL312218; SCHEMBL5577038; CGS 27023A Analog 32 ...
MW:     384.834580 g/mol MF: C16H17ClN2O5S
IUPAC name: 2-[(4-chlorophenyl)methyl-(4-methoxyphenyl)sulfonylamino]-N-...
Create Date: 2006-10-25
CID: 9843079

4366. CHEMBL487851; SCHEMBL1863506; BDBM24606 ...
MW:     339.348580 g/mol MF: C17H17N5O3
IUPAC name: methyl 2-(ethylcarbamoylamino)-6-pyridin-3-yl-1H-benzimidazo...
Create Date: 2006-10-25
CID: 9840840

4367. CHEMBL85030; SCHEMBL7349429; CGS 27023A Analog 58 ...
MW:     392.469260 g/mol MF: C19H24N2O5S
IUPAC name: (2R)-2-[benzyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxy-3-m...
Create Date: 2006-10-25
CID: 9821883

4368. CHEMBL62993; Isatin Sulfonamide 29; Pyrrolidine Isatin Analogue 10 ...
MW:     386.421620 g/mol MF: C19H18N2O5S
IUPAC name: 5-[(2S)-2-(phenoxymethyl)pyrrolidin-1-yl]sulfonyl-1H-indole-...
Create Date: 2006-10-25
CID: 9821545

4369. CHEMBL195915; SCHEMBL6164730; 1,2,3-triazole analogue, 24 ...
MW:     302.953400 g/mol MF: C8H5Br2N3
IUPAC name: 4-(3,4-dibromophenyl)-2H-triazole
Create Date: 2006-10-25
CID: 9814912

4370. 1H-1,2,3-Triazole, 5-(2-methylphenyl)-; 369363-70-2; ACMC-1CLI8 ...
MW:     159.187860 g/mol MF: C9H9N3
IUPAC name: 4-(2-methylphenyl)-2H-triazole
Create Date: 2006-10-25
CID: 9812842

4371. 4-BROMO-3-(CARBOXYMETHOXY)-5-PHENYLTHIOPHENE-2-CARBOXYLIC ACID; CHEMBL213758; 2h4k ...
MW:     357.176560 g/mol MF: C13H9BrO5S
IUPAC name: 4-bromo-3-(carboxymethoxy)-5-phenylthiophene-2-carboxylic ac...
Create Date: 2006-09-12
CID: 9547959

4372. 4-BROMO-3-(CARBOXYMETHOXY)-5-(4-HYDROXYPHENYL)THIOPHENE-2-CARBOXYLIC ACID; 2h4g; Monocyclic thiophene analog 17 ...
MW:     373.175960 g/mol MF: C13H9BrO6S
IUPAC name: 4-bromo-3-(carboxymethoxy)-5-(4-hydroxyphenyl)thiophene-2-ca...
Create Date: 2006-09-12
CID: 9547958

4373. AC1O7VFF; ChemDiv3_010790; MLS000925236 ...
MW:     423.488140 g/mol MF: C21H21N5O3S
IUPAC name: 3-(4-methylphenyl)sulfonyl-N-(oxolan-2-ylmethyl)triazolo[1,5...
Create Date: 2006-06-05
CID: 6623051

4374. 5-[2-bromo-5-[(2,4-diaminopyrimidin-5-yl)methyl]-3-methoxyphenyl]pent-4-ynoic acid; 5-{2-bromo-5-[(2,4-diaminopyrimidin-5-yl)methyl]-3-methoxyphenyl}pent-4-ynoic acid; AC1O5AQ9 ...
MW:     405.245880 g/mol MF: C17H17BrN4O3
IUPAC name: 5-[2-bromo-5-[(2,4-diaminopyrimidin-5-yl)methyl]-3-methoxyph...
Create Date: 2006-04-29
CID: 6481085

4375. CHEMBL89566; SQUALESTATIN ANALOG 35; AC1O6F89 ...
MW:     748.767420 g/mol MF: C37H48O16
IUPAC name: (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetyloxy-5-methyl-3-methyl...
Create Date: 2006-04-29
CID: 6474279

4376. CHEMBL87902; SQUALESTATIN ANALOG 26; AC1O6F88 ...
MW:     816.927500 g/mol MF: C43H60O15
IUPAC name: (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetyloxy-5-methyl-3-methyl...
Create Date: 2006-04-29
CID: 6474278

4377. CHEMBL314850; SQUALESTATIN ANALOG 24; AC1O6F87 ...
MW:     732.768020 g/mol MF: C37H48O15
IUPAC name: (1S,3S,4S,5R,6R,7R)-7-acetyloxy-1-[(4S,5R)-4-acetyloxy-5-met...
Create Date: 2006-04-29
CID: 6474277

4378. 9-cis-Retinal; Isoretinene A; 9-cis-Retinaldehyde ...
MW:     284.435720 g/mol MF: C20H28O
IUPAC name: (2E,4E,6Z,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl...
Create Date: 2006-04-28
CID: 6436082

4379. CHEMBL194853; R20; 4-(m-tolyl)-1H-1,2,3-triazole ...
MW:     159.187860 g/mol MF: C9H9N3
IUPAC name: 4-(3-methylphenyl)-2H-triazole
Create Date: 2005-11-29
CID: 6419227

4380. CHEMBL286991; CHEMBL543166; GBR-13,069 ...
MW:     448.547406 g/mol MF: C28H30F2N2O
IUPAC name: 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-[(E)-3-phenylprop-...
Create Date: 2005-09-12
CID: 5974189

4381. AC1MHVFR; 1,3,4-oxadiazole analog 24; BDBM9116 ...
MW:     823.256390 g/mol MF: C41H42ClF3N6O7
IUPAC name: (2S)-4-[[5-(4-chlorophenyl)furan-2-yl]methyl]-1-[(2S,4S)-2-h...
Create Date: 2005-08-01
CID: 5743066

4382. AC1MHVF7; 1,3,4-oxadiazole analog 17; BDBM9109 ...
MW:     776.201650 g/mol MF: C36H41ClF3N7O7
IUPAC name: (2S)-4-[2-[5-(4-chlorophenyl)-1,3-oxazol-2-yl]propan-2-yl]-1...
Create Date: 2005-08-01
CID: 5743065

4383. AC1MHVEV; 1,3,4-oxadiazole analog 13; BDBM9105 ...
MW:     759.747053 g/mol MF: C36H41F4N7O7
IUPAC name: (2S)-4-[2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]propan-2-yl]-1...
Create Date: 2005-08-01
CID: 5743064

4384. AC1NUHZT; CHEMBL95419; BDBM1253 ...
MW:     511.652940 g/mol MF: C29H41N3O5
IUPAC name: tert-butyl N-[(2S,3S,5R)-6-[[(2S)-1-amino-3-methyl-1-oxobuta...
Create Date: 2005-08-01
CID: 5479269

4385. AC1NS9OH; BDBM6880; SCHEMBL5964649 ...
MW:     425.436226 g/mol MF: C15H13F2N7O2S2
IUPAC name: 3-amino-N-(2,6-difluorophenyl)-5-(4-sulfamoylanilino)-1,2,4-...
Create Date: 2006-01-30
CID: 5330814

4386. AC1NS9OE; BDBM6879; CHEMBL190171 ...
MW:     408.382566 g/mol MF: C16H14F2N6O3S
IUPAC name: 4-[[5-amino-2-(2,6-difluoro-3-methylbenzoyl)-1,2,4-triazol-3...
Create Date: 2006-01-30
CID: 5330813

4387. AC1NS9O8; BDBM6877; CHEMBL370698 ...
MW:     409.370626 g/mol MF: C15H13F2N7O3S
IUPAC name: 5-amino-N-(2,6-difluorophenyl)-3-(4-sulfamoylanilino)-1,2,4-...
Create Date: 2006-01-30
CID: 5330811

4388. AC1NS9O5; BDBM6876; SCHEMBL5964775 ...
MW:     430.409686 g/mol MF: C14H12F2N6O4S2
IUPAC name: 4-[[5-amino-1-(2,6-difluorophenyl)sulfonyl-1,2,4-triazol-3-y...
Create Date: 2006-01-30
CID: 5330810

4389. AC1NS9O2; BDBM6875; CHEMBL187345 ...
MW:     380.372466 g/mol MF: C15H14F2N6O2S
IUPAC name: 4-[[5-amino-1-[(2,6-difluorophenyl)methyl]-1,2,4-triazol-3-y...
Create Date: 2006-01-30
CID: 5330809

4390. AC1NS9NZ; BDBM6874; CHEMBL190955 ...
MW:     462.473006 g/mol MF: C20H20F2N6O3S
IUPAC name: [5-amino-3-(4-piperidin-1-ylsulfonylanilino)-1,2,4-triazol-1...
Create Date: 2006-01-30
CID: 5330808

4391. AC1NS9NW; BDBM6873; CHEMBL190453 ...
MW:     465.476946 g/mol MF: C19H21F2N7O3S
IUPAC name: 4-[[5-amino-1-(2,6-difluorobenzoyl)-1,2,4-triazol-3-yl]amino...
Create Date: 2006-01-30
CID: 5330807

4392. AC1NS9NT; BDBM6872; CHEMBL361900 ...
MW:     382.393243 g/mol MF: C13H11FN6O3S2
IUPAC name: 4-[[5-amino-1-(3-fluorothiophene-2-carbonyl)-1,2,4-triazol-3...
Create Date: 2006-01-30
CID: 5330806

4393. AC1NS9NQ; BDBM6871; CHEMBL187395 ...
MW:     392.455940 g/mol MF: C15H16N6O3S2
IUPAC name: 4-[[5-amino-1-(3,5-dimethylthiophene-2-carbonyl)-1,2,4-triaz...
Create Date: 2006-01-30
CID: 5330805

4394. AC1NS9NN; BDBM6870; CHEMBL363130 ...
MW:     378.429360 g/mol MF: C14H14N6O3S2
IUPAC name: 4-[[5-amino-1-(3-methylthiophene-2-carbonyl)-1,2,4-triazol-3...
Create Date: 2006-01-30
CID: 5330804

4395. AC1NS9NK; BDBM6869; CHEMBL190643 ...
MW:     364.402780 g/mol MF: C13H12N6O3S2
IUPAC name: 4-[[5-amino-1-(thiophene-2-carbonyl)-1,2,4-triazol-3-yl]amin...
Create Date: 2006-01-30
CID: 5330803

4396. AC1NS9NH; BDBM6868; SCHEMBL5725430 ...
MW:     412.346450 g/mol MF: C15H11F3N6O3S
IUPAC name: 4-[[5-amino-1-(2,3,6-trifluorobenzoyl)-1,2,4-triazol-3-yl]am...
Create Date: 2006-01-30
CID: 5330802

4397. AC1NS9NE; BDBM6867; SCHEMBL5727292 ...
MW:     408.382566 g/mol MF: C16H14F2N6O3S
IUPAC name: 4-[[5-amino-1-(2,6-difluoro-3-methylbenzoyl)-1,2,4-triazol-3...
Create Date: 2006-01-30
CID: 5330800

4398. AC1NS9N6; BDBM6865; CHEMBL189855 ...
MW:     358.375060 g/mol MF: C15H14N6O3S
IUPAC name: 4-[(5-amino-1-benzoyl-1,2,4-triazol-3-yl)amino]benzenesulfon...
Create Date: 2006-01-30
CID: 5330789

4399. 2-amino-5-thio-substituted thiazole 31; AC1NS7E8; CHEMBL48796 ...
MW:     373.492360 g/mol MF: C18H19N3O2S2
IUPAC name: N-[5-[(5-tert-butyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thia...
Create Date: 2006-01-30
CID: 5329687

4400. 2-aminothiazole 2; 2-amino-5-thio-substituted thiazole 25; AC1NS7CD ...
MW:     311.422980 g/mol MF: C13H17N3O2S2
IUPAC name: N-[5-[(5-tert-butyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thia...
Create Date: 2006-01-30
CID: 5329665

4401. AC1NS6JE; BDBM5237; CHEMBL331151 ...
MW:     311.376700 g/mol MF: C15H25N3O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-(2-ethylbutanoylamino)cyclo...
Create Date: 2006-01-30
CID: 5329316

4402. AC1NS6JB; BDBM5236; CHEMBL320496 ...
MW:     283.323540 g/mol MF: C13H21N3O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-(2-methylpropanoylamino)cyc...
Create Date: 2006-01-30
CID: 5329315

4403. AC1NS6J8; BDBM5235; CHEMBL112581 ...
MW:     269.296960 g/mol MF: C12H19N3O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-(propanoylamino)cyclohexene...
Create Date: 2006-01-30
CID: 5329314

4404. CHEMBL320978; AC1NS6J5; BDBM5234 ...
MW:     283.366600 g/mol MF: C14H25N3O3
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-(pentan-3-ylamino)cyclohexe...
Create Date: 2006-01-30
CID: 5329313

4405. AC1NS6J2; BDBM5233; CHEMBL111857 ...
MW:     255.313440 g/mol MF: C12H21N3O3
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-(propylamino)cyclohexene-1-...
Create Date: 2006-01-30
CID: 5329312

4406. AC1NS6IZ; BDBM5232; CHEMBL420120 ...
MW:     297.393180 g/mol MF: C15H27N3O3
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-(dipropylamino)cyclohexene-...
Create Date: 2006-01-30
CID: 5329311

4407. AC1NS6IW; BDBM5231; CHEMBL113102 ...
MW:     297.393180 g/mol MF: C15H27N3O3
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-[butyl(ethyl)amino]cyclohex...
Create Date: 2006-01-30
CID: 5329310

4408. AC1NS6IT; BDBM5230; CHEMBL112184 ...
MW:     283.366600 g/mol MF: C14H25N3O3
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-[ethyl(propyl)amino]cyclohe...
Create Date: 2006-01-30
CID: 5329309

4409. AC1NS6IQ; BDBM5229; CHEMBL320788 ...
MW:     309.403880 g/mol MF: C16H27N3O3
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-[cyclohexyl(methyl)amino]cy...
Create Date: 2006-01-30
CID: 5329308

4410. AC1NS6IN; BDBM5228; CHEMBL113191 ...
MW:     331.409400 g/mol MF: C18H25N3O3
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-[methyl(2-phenylethyl)amino...
Create Date: 2006-01-30
CID: 5329307

4411. AC1NS6IK; BDBM5227; CHEMBL112356 ...
MW:     297.393180 g/mol MF: C15H27N3O3
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-[methyl(pentan-3-yl)amino]c...
Create Date: 2006-01-30
CID: 5329306

4412. AC1NS6IH; BDBM5226; CHEMBL420495 ...
MW:     283.366600 g/mol MF: C14H25N3O3
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-[butyl(methyl)amino]cyclohe...
Create Date: 2006-01-30
CID: 5329305

4413. AC1NS6IE; BDBM5225; CHEMBL440151 ...
MW:     269.340020 g/mol MF: C13H23N3O3
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-[methyl(propyl)amino]cycloh...
Create Date: 2006-01-30
CID: 5329304

4414. AC1NS3JN; CHEMBL53025; BDBM3241 ...
MW:     559.526800 g/mol MF: C28H25N5O8
IUPAC name: [(1R,2R)-2-[(4-hydroxybenzoyl)amino]cyclopentyl] 3,5-dihydro...
Create Date: 2006-01-30
CID: 5328000

4415. AC1NS3JK; BDBM3240; CHEMBL298159 ...
MW:     559.526800 g/mol MF: C28H25N5O8
IUPAC name: [(1R,2R)-2-[(4-hydroxybenzoyl)amino]cyclopentyl] 3,5-dihydro...
Create Date: 2006-01-30
CID: 5327999

4416. AC1NS3JH; BDBM3239; CHEMBL298872 ...
MW:     545.500220 g/mol MF: C27H23N5O8
IUPAC name: [(1R,2R)-2-[(4-hydroxybenzoyl)amino]cyclopentyl] 3,5-dihydro...
Create Date: 2006-01-30
CID: 5327998

4417. AC1NS3JE; BDBM3238; CHEMBL299987 ...
MW:     534.514040 g/mol MF: C28H26N2O9
IUPAC name: [(1R,2R)-2-[(4-hydroxybenzoyl)amino]cyclopentyl] 4-(2-acetam...
Create Date: 2006-01-30
CID: 5327997

4418. AC1NS3JB; CHEMBL55890; BDBM3237 ...
MW:     588.485430 g/mol MF: C28H23F3N2O9
IUPAC name: [(1R,2R)-2-[(4-hydroxybenzoyl)amino]cyclopentyl] 3,5-dihydro...
Create Date: 2006-01-30
CID: 5327996

4419. AC1NS3J8; BDBM3236; CHEMBL294166 ...
MW:     570.567740 g/mol MF: C27H26N2O10S
IUPAC name: [(1R,2R)-2-[(4-hydroxybenzoyl)amino]cyclopentyl] 3,5-dihydro...
Create Date: 2006-01-30
CID: 5327995

4420. AC1NS3J5; CHEMBL52869; BDBM3235 ...
MW:     624.539130 g/mol MF: C27H23F3N2O10S
IUPAC name: [(1R,2R)-2-[(4-hydroxybenzoyl)amino]cyclopentyl] 3,5-dihydro...
Create Date: 2006-01-30
CID: 5327994

4421. AC1NS3J2; BDBM3234; Modified Benzophenone Carboxylic Acid, Balanol Analog 34 ...
MW:     551.498200 g/mol MF: C28H25NO11
IUPAC name: 2-[2-[2,6-dihydroxy-4-[(1R,2R)-2-[(4-hydroxybenzoyl)amino]cy...
Create Date: 2006-01-30
CID: 5327993

4422. AC1NS3IZ; BDBM3233; Modified Benzophenone Carboxylic Acid, Balanol Analog 33 ...
MW:     536.529920 g/mol MF: C28H28N2O9
IUPAC name: [(1R,2R)-2-[(4-hydroxybenzoyl)amino]cyclopentyl] 4-[2-(2-ami...
Create Date: 2006-01-30
CID: 5327992

4423. AC1NS3IW; BDBM3232; Modified Benzophenone Carboxylic Acid, Balanol Analog 32 ...
MW:     502.472180 g/mol MF: C27H22N2O8
IUPAC name: [(1R,2R)-2-[(4-hydroxybenzoyl)amino]cyclopentyl] 4-(2-cyano-...
Create Date: 2006-01-30
CID: 5327991

4424. AC1NS3IT; BDBM3231; Modified Benzophenone Carboxylic Acid, Balanol Analog 31 ...
MW:     536.529920 g/mol MF: C28H28N2O9
IUPAC name: [(3R,4R)-3-[(4-hydroxybenzoyl)amino]azepan-4-yl] 3,5-dihydro...
Create Date: 2006-01-30
CID: 5327990

4425. AC1NS3FB; BDBM3187; CHEMBL345767 ...
MW:     607.584600 g/mol MF: C30H25NO11S
IUPAC name: 2-[4-[(2R)-2-(benzenesulfonamido)-3-(4-hydroxyphenyl)propoxy...
Create Date: 2006-01-30
CID: 5327948

4426. AC1NS3F8; BDBM3186; CHEMBL151822 ...
MW:     607.584600 g/mol MF: C30H25NO11S
IUPAC name: 2-[4-[(2S)-2-(benzenesulfonamido)-3-(4-hydroxyphenyl)propoxy...
Create Date: 2006-01-30
CID: 5327947

4427. AC1NS2D6; BDBM676; CHEMBL53979 ...
MW:     617.773340 g/mol MF: C33H51N3O8
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-4-[4-(...
Create Date: 2006-01-30
CID: 5327441

4428. CHEMBL293034; 1-methyl-5-(2-phenoxymethyl-pyrrolidine-1-sulfonyl)-1h-indole-2,3-dione; Isatin Sulfonamide 31 ...
MW:     400.448200 g/mol MF: C20H20N2O5S
IUPAC name: 1-methyl-5-[(2S)-2-(phenoxymethyl)pyrrolidin-1-yl]sulfonylin...
Create Date: 2005-11-29
CID: 5288850

4429. balanol; Azepinostatin; 63590-19-2 ...
MW:     550.513440 g/mol MF: C28H26N2O10
IUPAC name: 2-[2,6-dihydroxy-4-[(3R,4R)-3-[(4-hydroxybenzoyl)amino]azepa...
Create Date: 2005-11-29
CID: 5287736

4430. AS-662/12126296; AC1NCYD0; Modified amino acid analog, 5 ...
MW:     313.347760 g/mol MF: C18H19NO4
IUPAC name: 5-oxo-5-(4-phenylmethoxyanilino)pentanoic acid
Create Date: 2005-09-15
CID: 4566654

4431. CHEMBL321511; JS-2168; 6-NITRO-N-(3-(TRIFLUOROMETHYL)PHENYL)QUINAZOLIN-4-AMINE ...
MW:     334.252770 g/mol MF: C15H9F3N4O2
IUPAC name: 6-nitro-N-[3-(trifluoromethyl)phenyl]quinazolin-4-amine
Create Date: 2005-09-09
CID: 3564138

4432. AC1MHVG3; 1,3,4-oxadiazole analog 28; BDBM9120 ...
MW:     848.866590 g/mol MF: C42H47F3N8O8
IUPAC name: (2S)-1-[(2S,4S)-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4-dihydro-...
Create Date: 2005-08-01
CID: 3012107

4433. AC1MHVG0; 1,3,4-oxadiazole analog 27; BDBM9119 ...
MW:     814.850370 g/mol MF: C39H49F3N8O8
IUPAC name: (2S)-1-[(2S,4S)-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4-dihydro-...
Create Date: 2005-08-01
CID: 3012106

4434. AC1MHVFX; 1,3,4-oxadiazole analog 26; BDBM9118 ...
MW:     786.797210 g/mol MF: C37H45F3N8O8
IUPAC name: (2S)-1-[(2S,4S)-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4-dihydro-...
Create Date: 2005-08-01
CID: 3012105

4435. AC1MHVFU; 1,3,4-oxadiazole analog 25; BDBM9117 ...
MW:     772.770630 g/mol MF: C36H43F3N8O8
IUPAC name: (2S)-1-[(2S,4S)-2-hydroxy-5-[[(3S,4S)-3-hydroxy-3,4-dihydro-...
Create Date: 2005-08-01
CID: 3012104

4436. AC1MHVFO; 1,3,4-oxadiazole analog 23; BDBM9115 ...
MW:     789.240170 g/mol MF: C38H44ClF3N6O7
IUPAC name: (2S)-4-[[5-(4-chlorophenyl)furan-2-yl]methyl]-1-[(2S,4S)-2-h...
Create Date: 2005-08-01
CID: 3012102

4437. AC1MHVFM; 1,3,4-oxadiazole analog 22; BDBM9114 ...
MW:     761.187010 g/mol MF: C36H40ClF3N6O7
IUPAC name: (2S)-4-[[5-(4-chlorophenyl)furan-2-yl]methyl]-1-[(2S,4S)-2-h...
Create Date: 2005-08-01
CID: 3012101

4438. AC1MHVFJ; 1,3,4-oxadiazole analog 21; BDBM9113 ...
MW:     747.160430 g/mol MF: C35H38ClF3N6O7
IUPAC name: (2S)-4-[[5-(4-chlorophenyl)furan-2-yl]methyl]-1-[(2S,4S)-2-h...
Create Date: 2005-08-01
CID: 3012100

4439. AC1MHVFG; 1,3,4-oxadiazole analog 20; BDBM9112 ...
MW:     852.297610 g/mol MF: C42H45ClF3N7O7
IUPAC name: (2S)-4-[2-[5-(4-chlorophenyl)-1,3-oxazol-2-yl]propan-2-yl]-1...
Create Date: 2005-08-01
CID: 3012099

4440. AC1MHVFD; 1,3,4-oxadiazole analog 19; BDBM9111 ...
MW:     818.281390 g/mol MF: C39H47ClF3N7O7
IUPAC name: (2S)-4-[2-[5-(4-chlorophenyl)-1,3-oxazol-2-yl]propan-2-yl]-1...
Create Date: 2005-08-01
CID: 3012098

4441. AC1MHVFA; 1,3,4-oxadiazole analog 18; BDBM9110 ...
MW:     790.228230 g/mol MF: C37H43ClF3N7O7
IUPAC name: (2S)-4-[2-[5-(4-chlorophenyl)-1,3-oxazol-2-yl]propan-2-yl]-1...
Create Date: 2005-08-01
CID: 3012097

4442. AC1MHVF4; 1,3,4-oxadiazole analog 16; BDBM9108 ...
MW:     835.843013 g/mol MF: C42H45F4N7O7
IUPAC name: (2S)-4-[2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]propan-2-yl]-1...
Create Date: 2005-08-01
CID: 3012095

4443. AC1MHVF1; 1,3,4-oxadiazole analog 15; BDBM9107 ...
MW:     801.826793 g/mol MF: C39H47F4N7O7
IUPAC name: (2S)-4-[2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]propan-2-yl]-1...
Create Date: 2005-08-01
CID: 3012094

4444. AC1MHVEY; 1,3,4-oxadiazole analog 14; BDBM9106 ...
MW:     773.773633 g/mol MF: C37H43F4N7O7
IUPAC name: (2S)-4-[2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]propan-2-yl]-1...
Create Date: 2005-08-01
CID: 3012093

4445. 1-[2-(2-chloro-3-ethoxy-6-fluorophenyl)ethyl]-3-[5-(trifluoromethyl)-1,3-thiazol-2-yl]thiourea; AC1MHDM8; BDBM2130 ...
MW:     427.867773 g/mol MF: C15H14ClF4N3OS2
IUPAC name: 1-[2-(2-chloro-3-ethoxy-6-fluorophenyl)ethyl]-3-[5-(trifluor...
Create Date: 2005-08-01
CID: 3001161

4446. 181305-38-4; 1-(5-bromopyridin-2-yl)-3-[2-(2,5-diethoxyphenyl)ethyl]thiourea; Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-(2,5-diethoxyphenyl)ethyl)- ...
MW:     424.355180 g/mol MF: C18H22BrN3O2S
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-(2,5-diethoxyphenyl)ethyl]thiou...
Create Date: 2005-08-01
CID: 3001160

4447. 181305-36-2; 1-(5-chloropyridin-2-yl)-3-[2-(2,5-dimethoxyphenyl)ethyl]thiourea; Thiourea, N-(5-chloro-2-pyridinyl)-N'-(2-(2,5-dimethoxyphenyl)ethyl)- ...
MW:     351.851020 g/mol MF: C16H18ClN3O2S
IUPAC name: 1-(5-chloropyridin-2-yl)-3-[2-(2,5-dimethoxyphenyl)ethyl]thi...
Create Date: 2005-08-01
CID: 3001159

4448. 181305-34-0; Thiourea, N-(2-(2-cyano-6-fluoro-3-methoxyphenyl)ethyl)-N'-(5-cyano-2-pyridinyl)-; N-(2-(2-Cyano-3-methoxy-6-fluorophenethyl))-N'-(2-(5-cyanopyridyl))thiourea ...
MW:     355.389363 g/mol MF: C17H14FN5OS
IUPAC name: 1-[2-(2-cyano-6-fluoro-3-methoxyphenyl)ethyl]-3-(5-cyanopyri...
Create Date: 2005-08-01
CID: 3001157

4449. 181305-33-9; 1-(5-bromopyridin-2-yl)-3-[2-(2-cyano-6-fluoro-3-methoxyphenyl)ethyl]thiourea; Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-(2-cyano-6-fluoro-3-methoxyphenyl)ethyl)- ...
MW:     409.275963 g/mol MF: C16H14BrFN4OS
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-(2-cyano-6-fluoro-3-methoxyphen...
Create Date: 2005-08-01
CID: 3001156

4450. 181305-32-8; 1-(5-bromopyridin-2-yl)-3-[2-(2-cyano-3-ethoxy-6-fluorophenyl)ethyl]thiourea; Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-(2-cyano-3-ethoxy-6-fluorophenyl)ethyl)- ...
MW:     423.302543 g/mol MF: C17H16BrFN4OS
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-(2-cyano-3-ethoxy-6-fluoropheny...
Create Date: 2005-08-01
CID: 3001155

4451. 181305-28-2; Thiourea, N-(2-(2-chloro-3-ethoxy-6-fluorophenyl)ethyl)-N'-(5-cyano-2-pyridinyl)-; N-(2-(2-Chloro-3-ethoxy-6-fluorophenethyl))-N'-(2-(5-cyanopyridyl))thiourea ...
MW:     378.851543 g/mol MF: C17H16ClFN4OS
IUPAC name: 1-[2-(2-chloro-3-ethoxy-6-fluorophenyl)ethyl]-3-(5-cyanopyri...
Create Date: 2005-08-01
CID: 3001154

4452. 181305-27-1; Thiourea, N-(2-(2-chloro-3-ethoxy-6-fluorophenyl)ethyl)-N'-(5-iodo-2-pyridinyl)-; N-(2-(2-Chloro-3-ethoxy-6-fluorophenethyl))-N'-(2-(5-iodopyridyl))thiourea ...
MW:     479.738613 g/mol MF: C16H16ClFIN3OS
IUPAC name: 1-[2-(2-chloro-3-ethoxy-6-fluorophenyl)ethyl]-3-(5-iodopyrid...
Create Date: 2005-08-01
CID: 3001153

4453. PT-112; 167683-61-6; 1-(5-bromopyridin-2-yl)-3-[2-(2-chloro-3-ethoxy-6-fluorophenyl)ethyl]thiourea ...
MW:     432.738143 g/mol MF: C16H16BrClFN3OS
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-(2-chloro-3-ethoxy-6-fluorophen...
Create Date: 2005-08-01
CID: 3001152

4454. AC1MHDLS; BDBM2159; CHEMBL341201 ...
MW:     429.708140 g/mol MF: C16H11Cl3N4O2S
IUPAC name: 1-(5-chloropyridin-2-yl)-3-[2-(4,7-dichloro-1,3-dioxoisoindo...
Create Date: 2005-08-01
CID: 3001145

4455. AC1MHDLR; BDBM2156; CHEMBL135380 ...
MW:     360.818020 g/mol MF: C16H13ClN4O2S
IUPAC name: 1-(5-chloropyridin-2-yl)-3-[2-(1,3-dioxoisoindol-2-yl)ethyl]...
Create Date: 2005-08-01
CID: 3001144

4456. AC1MHDLQ; BDBM2155; LY300046HCl Analog 41 ...
MW:     376.274160 g/mol MF: C15H14BrN5S
IUPAC name: 1-[2-(1H-benzimidazol-2-yl)ethyl]-3-(5-bromopyridin-2-yl)thi...
Create Date: 2005-08-01
CID: 3001143

4457. 181305-57-7; Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-(5,6-dimethyl-2H-benzotriazol-2-yl)ethyl)-; N-(2-(5,6-Dimethylbenzotriazol-2-yl)ethyl)-N'-(2-(5-bromopyridyl))thiourea ...
MW:     405.315380 g/mol MF: C16H17BrN6S
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-(5,6-dimethylbenzotriazol-2-yl)...
Create Date: 2005-08-01
CID: 3001142

4458. 181305-56-6; 1-(5-bromopyridin-2-yl)-3-[2-(5-methoxy-1H-indol-3-yl)ethyl]thiourea; Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-(5-methoxy-1H-indol-3-yl)ethyl)- ...
MW:     405.312080 g/mol MF: C17H17BrN4OS
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-(5-methoxy-1H-indol-3-yl)ethyl]...
Create Date: 2005-08-01
CID: 3001141

4459. CHEMBL116350; 181305-55-5; 1-(5-bromopyridin-2-yl)-3-[2-(1H-indol-3-yl)ethyl]thiourea ...
MW:     375.286100 g/mol MF: C16H15BrN4S
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-(1H-indol-3-yl)ethyl]thiourea
Create Date: 2005-08-01
CID: 3001140

4460. 181305-54-4; 1-(5-chloropyridin-2-yl)-3-[2-(3-cyanofuran-2-yl)ethyl]thiourea; Thiourea, N-(5-chloro-2-pyridinyl)-N'-(2-(3-cyano-2-furanyl)ethyl)- ...
MW:     306.770640 g/mol MF: C13H11ClN4OS
IUPAC name: 1-(5-chloropyridin-2-yl)-3-[2-(3-cyanofuran-2-yl)ethyl]thiou...
Create Date: 2005-08-01
CID: 3001139

4461. 181305-53-3; 1-(5-chloropyridin-2-yl)-3-[2-(3-fluorofuran-2-yl)ethyl]thiourea; Thiourea, N-(5-chloro-2-pyridinyl)-N'-(2-(3-fluoro-2-furanyl)ethyl)- ...
MW:     299.751643 g/mol MF: C12H11ClFN3OS
IUPAC name: 1-(5-chloropyridin-2-yl)-3-[2-(3-fluorofuran-2-yl)ethyl]thio...
Create Date: 2005-08-01
CID: 3001138

4462. 149488-28-8; Thiourea, N-(5-chloro-2-pyridinyl)-N'-(2-(1-methyl-1H-pyrrol-2-yl)ethyl)-; N-(2-(1-Methylpyrrolyl)ethyl)-N'-(2-(5-chloropyridyl))thiourea ...
MW:     294.803000 g/mol MF: C13H15ClN4S
IUPAC name: 1-(5-chloropyridin-2-yl)-3-[2-(1-methylpyrrol-2-yl)ethyl]thi...
Create Date: 2005-08-01
CID: 3001137

4463. 181305-52-2; Thiourea, N-(5-cyano-2-pyridinyl)-N'-(2-(1-methyl-1H-pyrrol-2-yl)ethyl)-; N-(2-(1-Methylpyrrolyl)ethyl)-N'-(2-(5-cyanopyridyl))thiourea ...
MW:     285.367400 g/mol MF: C14H15N5S
IUPAC name: 1-(5-cyanopyridin-2-yl)-3-[2-(1-methylpyrrol-2-yl)ethyl]thio...
Create Date: 2005-08-01
CID: 3001136

4464. 181305-51-1; 1-(5-bromopyridin-2-yl)-3-[2-(2,4-dichloro-3-ethoxy-6-fluorophenyl)ethyl]thiourea; Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-(2,4-dichloro-3-ethoxy-6-fluorophenyl)ethyl)- ...
MW:     467.183203 g/mol MF: C16H15BrCl2FN3OS
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-(2,4-dichloro-3-ethoxy-6-fluoro...
Create Date: 2005-08-01
CID: 3001135

4465. 181305-50-0; Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-(3-cyano-4-(dimethylamino)-2-fluorophenyl)ethyl)-; 1-(5-bromopyridin-2-yl)-3-[2-[3-cyano-4-(dimethylamino)-2-fluorophenyl]ethyl]thiourea ...
MW:     422.317783 g/mol MF: C17H17BrFN5S
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-[3-cyano-4-(dimethylamino)-2-fl...
Create Date: 2005-08-01
CID: 3001134

4466. PT-114; 181305-49-7; Thiourea, N-(5-chloro-2-pyridinyl)-N'-(2-(4-(dimethylamino)-2,6-difluorophenyl)ethyl)- ...
MW:     370.847786 g/mol MF: C16H17ClF2N4S
IUPAC name: 1-(5-chloropyridin-2-yl)-3-[2-[4-(dimethylamino)-2,6-difluor...
Create Date: 2005-08-01
CID: 3001133

4467. 181305-47-5; 1-(5-bromopyridin-2-yl)-3-[2-(6-chloro-3-ethoxy-2-fluorophenyl)ethyl]thiourea; Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-(6-chloro-3-ethoxy-2-fluorophenyl)ethyl)- ...
MW:     432.738143 g/mol MF: C16H16BrClFN3OS
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-(6-chloro-3-ethoxy-2-fluorophen...
Create Date: 2005-08-01
CID: 3001131

4468. 181305-45-3; 1-(5-bromopyridin-2-yl)-3-[2-(6-fluoro-2,3-dimethoxyphenyl)ethyl]thiourea; Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-(6-fluoro-2,3-dimethoxyphenyl)ethyl)- ...
MW:     414.292483 g/mol MF: C16H17BrFN3O2S
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-(6-fluoro-2,3-dimethoxyphenyl)e...
Create Date: 2005-08-01
CID: 3001130

4469. 181305-44-2; 1-(5-chloropyridin-2-yl)-3-[2-(3-ethoxy-2-fluoro-6-methoxyphenyl)ethyl]thiourea; Thiourea, N-(5-chloro-2-pyridinyl)-N'-(2-(3-ethoxy-2-fluoro-6-methoxyphenyl)ethyl)- ...
MW:     383.868063 g/mol MF: C17H19ClFN3O2S
IUPAC name: 1-(5-chloropyridin-2-yl)-3-[2-(3-ethoxy-2-fluoro-6-methoxyph...
Create Date: 2005-08-01
CID: 3001129

4470. 181305-42-0; 1-(5-chloropyridin-2-yl)-3-[2-(2-fluoro-3,6-dimethoxyphenyl)ethyl]thiourea; Thiourea, N-(5-chloro-2-pyridinyl)-N'-(2-(2-fluoro-3,6-dimethoxyphenyl)ethyl)- ...
MW:     369.841483 g/mol MF: C16H17ClFN3O2S
IUPAC name: 1-(5-chloropyridin-2-yl)-3-[2-(2-fluoro-3,6-dimethoxyphenyl)...
Create Date: 2005-08-01
CID: 3001128

4471. 181305-41-9; 1-(5-bromopyridin-2-yl)-3-[2-(2,3-difluoro-6-methoxyphenyl)ethyl]thiourea; Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-(2,3-difluoro-6-methoxyphenyl)ethyl)- ...
MW:     402.256966 g/mol MF: C15H14BrF2N3OS
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-(2,3-difluoro-6-methoxyphenyl)e...
Create Date: 2005-08-01
CID: 3001127

4472. 181305-40-8; 1-(5-bromopyridin-2-yl)-3-[2-(6-ethoxy-2,3-difluorophenyl)ethyl]thiourea; Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-(6-ethoxy-2,3-difluorophenyl)ethyl)- ...
MW:     416.283546 g/mol MF: C16H16BrF2N3OS
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-(6-ethoxy-2,3-difluorophenyl)et...
Create Date: 2005-08-01
CID: 3001126

4473. 181305-26-0; Thiourea, N-(2-(2-chloro-3-ethoxy-6-fluorophenyl)ethyl)-N'-(5-chloro-2-pyridinyl)-; N-(2-(2-Chloro-3-ethoxy-6-fluorophenethyl))-N'-(2-(5-chloropyridyl))thiourea ...
MW:     388.287143 g/mol MF: C16H16Cl2FN3OS
IUPAC name: 1-[2-(2-chloro-3-ethoxy-6-fluorophenyl)ethyl]-3-(5-chloropyr...
Create Date: 2005-08-01
CID: 3001081

4474. F1604-0117; ZINC02690460; AC1M23R9 ...
MW:     393.462160 g/mol MF: C20H19N5O2S
IUPAC name: 3-(benzenesulfonyl)-N-cyclopentyltriazolo[1,5-a]quinazolin-5...
Create Date: 2005-07-14
CID: 2136385

4475. N-(furan-2-ylmethyl)-3-(phenylsulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine; AC1M21HT; PSTQ Analog, 3{1,22} ...
MW:     405.429800 g/mol MF: C20H15N5O3S
IUPAC name: 3-(benzenesulfonyl)-N-(furan-2-ylmethyl)triazolo[1,5-a]quina...
Create Date: 2005-07-14
CID: 2135179

4476. CHEMBL94431; 11N-112; N-(3-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine ...
MW:     299.299663 g/mol MF: C16H14FN3O2
IUPAC name: N-(3-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine
Create Date: 2005-07-11
CID: 1474883

4477. CHEMBL328106; 11N-066; N-(4-bromophenyl)-6,7-dimethoxy-4-quinazolinamine ...
MW:     360.205260 g/mol MF: C16H14BrN3O2
IUPAC name: N-(4-bromophenyl)-6,7-dimethoxyquinazolin-4-amine
Create Date: 2005-07-11
CID: 1474852

4478. (4-Oxo-5-thiophen-2-ylmethylene-2-thioxo-thiazolidin-3-yl)-acetic acid; 82158-62-1; AC1Q75TT ...
MW:     285.362480 g/mol MF: C10H7NO3S3
IUPAC name: 2-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1...
Create Date: 2005-07-10
CID: 1201190

4479. AC1LDHKD; SCHEMBL4545434; Fentanyl meta methylphenyl analog ...
MW:     350.497100 g/mol MF: C23H30N2O
IUPAC name: N-[1-[2-(3-methylphenyl)ethyl]piperidin-4-yl]-N-phenylpropan...
Create Date: 2005-03-27
CID: 618627

4480. 4-(4-Chlorophenyl)-1H-1,2,3-triazole; 1H-1,2,3-Triazole, 4-(4-chlorophenyl)-; 5-(4-chlorophenyl)-1H-1,2,3-triazole ...
MW:     179.606340 g/mol MF: C8H6ClN3
IUPAC name: 4-(4-chlorophenyl)-2H-triazole
Create Date: 2005-03-27
CID: 601577

4481. 4-(p-Tolyl)-1H-1,2,3-triazole; 5301-96-2; 1H-1,2,3-Triazole, 4-(4-methylphenyl)- ...
MW:     159.187860 g/mol MF: C9H9N3
IUPAC name: 4-(4-methylphenyl)-2H-triazole
Create Date: 2005-03-27
CID: 594397

4482. Carbophenoxon sulfone; s-{[(4-chlorophenyl)sulfonyl]methyl} o,o-diethyl phosphorothioate; Trithion oxon sulfone ...
MW:     358.798502 g/mol MF: C11H16ClO5PS2
IUPAC name: 1-chloro-4-(diethoxyphosphorylsulfanylmethylsulfonyl)benzene
Create Date: 2005-03-27
CID: 572846

4483. AC1LA28X; CHEMBL54652; BDBM5238 ...
MW:     272.363800 g/mol MF: C12H20N2O3S
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-propylsulfanylcyclohexene-1...
Create Date: 2005-08-01
CID: 505927

4484. N-(4-carbamoylphenyl)-2-[[2-[(4-carbamoylphenyl)carbamoyl]phenyl]disulfanyl]benzamide; 2,2'-Dithiobis[N-[4-(aminocarbonyl)phenyl]benzamide]; 2,2'-Dithiobis{N-[4-(aminocarbonyl)phenyl]benzamide} ...
MW:     542.628680 g/mol MF: C28H22N4O4S2
IUPAC name: N-(4-carbamoylphenyl)-2-[[2-[(4-carbamoylphenyl)carbamoyl]ph...
Create Date: 2005-08-01
CID: 465343

4485. 175233-85-9; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-11-oxo-3-((4-(3-(3-oxo-4-morpholinyl)propoxy)phenyl)methyl)-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-11-oxo-3-[[4-[3-(3-oxo-4-morpholinyl)propoxy]phenyl]methyl]-9-(phenylmethyl)-, 1,1-dimethylethyl ester, [3S-(3R*,4S*,8S*,9R*)]- ...
MW:     700.861940 g/mol MF: C37H56N4O9
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-3-[(2-...
Create Date: 2005-08-01
CID: 463299

4486. 162539-73-3; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-3-((4-(3-(4-morpholinyl)propoxy)phenyl)methyl)-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-3-[[4-[3-(4-morpholinyl)propoxy]phenyl]methyl]-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, [3S-(3R*,4S*,8S*,9R*)]- ...
MW:     686.878420 g/mol MF: C37H58N4O8
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-3-[(2-...
Create Date: 2005-08-01
CID: 463298

4487. 162540-58-1; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-3-((4-(4-methoxybutoxy)phenyl)methyl)-13,13-dimethyl-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-3-[[4-(4-methoxybutoxy)phenyl]methyl]-13,13-dimethyl-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, [3S-(3R*,4S*,8S*,9R*)]- ...
MW:     645.826500 g/mol MF: C35H55N3O8
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-4-[4-(...
Create Date: 2005-08-01
CID: 463297

4488. 162540-08-1; 12-Oxa-2,6,10-triazatetradecanoic acid, 3-((4-(2-benzoxazolylmethoxy)phenyl)methyl)-4,8-dihydroxy-13,13-dimethyl-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-; 12-Oxa-2,6,10-triazatetradecanoic acid, 3-[[4-(2-benzoxazolylmethoxy)phenyl]methyl]-4,8-dihydroxy-13,13-dimethyl-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, [3S-(3R*,4S*,8S*,9R*)]- ...
MW:     690.825600 g/mol MF: C38H50N4O8
IUPAC name: tert-butyl N-[(2S,3R)-1-[4-(1,3-benzoxazol-2-ylmethoxy)pheny...
Create Date: 2005-08-01
CID: 463296

4489. 162540-10-5; 12-Oxa-2,6,10-triazatetradecanoic acid, 3-((4-(3-(2-benzoxazolyl)propoxy)phenyl)methyl)-4,8-dihydroxy-13,13-dimethyl-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-; 12-Oxa-2,6,10-triazatetradecanoic acid, 3-[[4-[3-(2-benzoxazolyl)propoxy]phenyl]methyl]-4,8-dihydroxy-13,13-dimethyl-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, [3S-(3R*,4S*,8S*,9R*)]- ...
MW:     718.878760 g/mol MF: C40H54N4O8
IUPAC name: tert-butyl N-[(2S,3R)-1-[4-[3-(1,3-benzoxazol-2-yl)propoxy]p...
Create Date: 2005-08-01
CID: 463295

4490. 162538-23-0; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-11-oxo-3-((3-(phenylmethoxy)phenyl)methyl)-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-11-oxo-3-[[3-(phenylmethoxy)phenyl]methyl]-9-(phenylmethyl)-, 1,1-dimethylethyl ester, [3S-(3R*,4S*,8S*,9R*)]- ...
MW:     649.816740 g/mol MF: C37H51N3O7
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-3-[(2-...
Create Date: 2005-08-01
CID: 463294

4491. 162539-58-4; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-11-oxo-3-((4-(phenylmethoxy)phenyl)methyl)-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-11-oxo-3-[[4-(phenylmethoxy)phenyl]methyl]-9-(phenylmethyl)-, 1,1-dimethylethyl ester, [3S-(3R*,4S*,8S*,9R*)]- ...
MW:     649.816740 g/mol MF: C37H51N3O7
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-3-[(2-...
Create Date: 2005-08-01
CID: 463293

4492. 175233-61-1; 4-Morpholinecarboxylic acid, (4-(2-(((1,1-dimethylethoxy)carbonyl)amino)-4-((3-(((1,1-dimethylethoxy)carbonyl)amino)-2-hydroxy-4-phenylbutyl)amino)-3-hydroxybutyl)phenyl)methyl ester, (2R-(1(2S*,3R*),2R*,3S*))-; 4-Morpholinecarboxylic acid, [4-[2-[[(1,1-dimethylethoxy)carbonyl]amino]-4-[[3-[[(1,1-dimethylethoxy)carbonyl]amino]-2-hydroxy-4-phenylbutyl]amino]-3-hydroxybutyl]phenyl]methyl ester, [2R-[1(2S*,3R*),2R*,3S*]]- ...
MW:     686.835360 g/mol MF: C36H54N4O9
IUPAC name: [4-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-3-[(2-methylprop...
Create Date: 2005-08-01
CID: 463292

4493. 162540-84-3; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-11-oxo-3-((4-(2-oxo-2-(1-piperidinyl)ethoxy)phenyl)methyl)-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-11-oxo-3-[[4-[2-oxo-2-(1-piperidinyl)ethoxy]phenyl]methyl]-9-(phenylmethyl)-, 1,1-dimethylethyl ester, [3S-(3R*,4S*,8S*,9R*)]- ...
MW:     684.862540 g/mol MF: C37H56N4O8
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-3-[(2-...
Create Date: 2005-08-01
CID: 463291

4494. 162539-54-0; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-3-((4-(2-(4-morpholinyl)ethoxy)phenyl)methyl)-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-3-[[4-[2-(4-morpholinyl)ethoxy]phenyl]methyl]-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, [3S-(3R*,4S*,8S*,9R*)]- ...
MW:     672.851840 g/mol MF: C36H56N4O8
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-3-[(2-...
Create Date: 2005-08-01
CID: 463290

4495. 175233-60-0; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-3-((4-(3-(4-morpholinyl)-3-oxopropyl)phenyl)methyl)-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-3-[[4-[3-(4-morpholinyl)-3-oxopropyl]phenyl]methyl]-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, [3S-(3R*,4S*,8S*,9R*)]- ...
MW:     684.862540 g/mol MF: C37H56N4O8
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-3-[(2-...
Create Date: 2005-08-01
CID: 463289

4496. 162541-08-4; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-3-((4-(2-(3-methyl-2-oxo-1-imidazolidinyl)ethoxy)phenyl)methyl)-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-3-[[4-[2-(3-methyl-2-oxo-1-imidazolidinyl)ethoxy]phenyl]methyl]-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, [3S-(3R*,4S*,8S*,9R*)]- ...
MW:     685.850600 g/mol MF: C36H55N5O8
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-4-[4-[...
Create Date: 2005-08-01
CID: 463288

4497. 162540-90-1; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-11-oxo-3-((4-(2-(2-oxo-3-oxazolidinyl)ethoxy)phenyl)methyl)-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-11-oxo-3-[[4-[2-(2-oxo-3-oxazolidinyl)ethoxy]phenyl]methyl]-9-(phenylmethyl)-, 1,1-dimethylethyl ester, [3S-(3R*,4S*,8S*,9R*)]- ...
MW:     672.808780 g/mol MF: C35H52N4O9
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-3-[(2-...
Create Date: 2005-08-01
CID: 463287

4498. 162541-14-2; 12-Oxa-2,6,10-triazatetradecanoic acid, 3-((4-(2-(((dimethylamino)carbonyl)oxy)ethoxy)phenyl)methyl)-4,8-dihydroxy-13,13-dimethyl-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-; 12-Oxa-2,6,10-triazatetradecanoic acid, 3-[[4-[2-[[(dimethylamino)carbonyl]oxy]ethoxy]phenyl]methyl]-4,8-dihydroxy-13,13-dimethyl-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, [3S-(3R*,4S*,8S*,9R*)]- ...
MW:     674.824660 g/mol MF: C35H54N4O9
IUPAC name: 2-[4-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-3-[(2-methylpr...
Create Date: 2005-08-01
CID: 463286

4499. 162541-04-0; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-3-((4-(2-hydroxy-2-methylpropoxy)phenyl)methyl)-13,13-dimethyl-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-3-[[4-(2-hydroxy-2-methylpropoxy)phenyl]methyl]-13,13-dimethyl-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, [3S-(3R*,4S*,8S*,9R*)]- ...
MW:     631.799920 g/mol MF: C34H53N3O8
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-4-[4-(...
Create Date: 2005-08-01
CID: 463284

4500. 162539-95-9; [1S-[1R*,2S*(2S*,3R*)]]-[3-[[3-[[(1,1-Dimethylethoxy)-carbonyl]amino]-2-hydroxy-4-[4-(2-methoxyethoxy)phenyl]butyl]amino]-2-hydroxy-1-(phenylmethyl)propyl]carbamic Acid, 1,1-Dimethylethyl ester; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-3-((4-(2-methoxyethoxy)phenyl)methyl)-13,13-dimethyl-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))- ...
MW:     617.773340 g/mol MF: C33H51N3O8
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-4-[4-(...
Create Date: 2005-08-01
CID: 463282

4501. 162539-80-2; [1S-[1R*,2S*(2S*,3R*)]]-[3-[[3-[[(1,1-Dimethylethoxy)-carbonyl]amino]-2-hydroxy-4-[4-(2-hydroxyethoxy)phenyl]butyl]amino]-2-hydroxy-1-(phenylmethyl)propyl]carbamic Acid, 1,1-Dimethylethyl ester; 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-3-((4-(2-hydroxyethoxy)phenyl)methyl)-13,13-dimethyl-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))- ...
MW:     603.746760 g/mol MF: C32H49N3O8
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-1-[4-(2-hydroxyethoxy)phenyl...
Create Date: 2005-08-01
CID: 463281

4502. 162541-02-8; (1S-(1R*,2S*(2S*,3R*)))-(3-((3-(((1,1-Dimethylethoxy)-carbonyl)amino)-2-hydroxy-4-(4-(2-hydroxy-2-(3-pyridinyl)ethoxy)phenyl)butyl)amino)-2-hydroxy-1-(phenylmethyl)propyl)carbamic Acid, 1,1-Dimethylethyl ester; [1S-[1R*,2S*(2S*,3R*)]]-[3-[[3-[[(1,1-Dimethylethoxy)-carbonyl]amino]-2-hydroxy-4-[4-[2-hydroxy-2-(3-pyridinyl)ethoxy]phenyl]butyl]amino]-2-hydroxy-1-(phenylmethyl)propyl]carbamic Acid, 1,1-Dimethylethyl ester ...
MW:     680.830780 g/mol MF: C37H52N4O8
IUPAC name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-4-[4-(...
Create Date: 2005-08-01
CID: 463280

4503. CHEMBL313675; AC1LA2QE; SQUALESTATIN ANALOG 27 ...
MW:     664.694060 g/mol MF: C33H44O14
IUPAC name: (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetyloxy-5-methyl-3-methyl...
Create Date: 2005-08-01
CID: 460639

4504. CHEMBL89073; AC1LA2QB; SQUALESTATIN ANALOG 36 ...
MW:     596.533980 g/mol MF: C27H32O15
IUPAC name: (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetyloxy-5-methyl-3-methyl...
Create Date: 2005-08-01
CID: 460638

4505. CHEMBL88601; AC1LA2Q8; SQUALESTATIN ANALOG 34 ...
MW:     708.746620 g/mol MF: C35H48O15
IUPAC name: (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetyloxy-5-methyl-3-methyl...
Create Date: 2005-08-01
CID: 460636

4506. CHEMBL315705; AC1LA2Q5; SQUELASTATIN ANALOG 33 ...
MW:     638.613720 g/mol MF: C30H38O15
IUPAC name: (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetyloxy-5-methyl-3-methyl...
Create Date: 2005-08-01
CID: 460635

4507. CHEMBL263760; AC1LA2Q2; SQUALESTATIN ANALOG 32 ...
MW:     596.533980 g/mol MF: C27H32O15
IUPAC name: (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetyloxy-5-methyl-3-methyl...
Create Date: 2005-08-01
CID: 460634

4508. CHEMBL89470; AC1LA2PZ; SQUALESTATIN ANALOG 31 ...
MW:     622.571260 g/mol MF: C29H34O15
IUPAC name: (1S,3S,4S,5R,6R,7R)-6,7-diacetyloxy-1-[(4S,5R)-4-acetyloxy-5...
Create Date: 2005-08-01
CID: 460633

4509. CHEMBL432033; AC1LA2PW; SQUALESTATIN ANALOG 30 ...
MW:     790.890220 g/mol MF: C41H58O15
IUPAC name: (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetyloxy-5-methyl-3-methyl...
Create Date: 2005-08-01
CID: 460632

4510. CHEMBL316436; AC1LA2PT; SQUALESTATIN ANALOG 29 ...
MW:     678.677580 g/mol MF: C33H42O15
IUPAC name: (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetyloxy-5-methyl-3-methyl...
Create Date: 2005-08-01
CID: 460631

4511. CHEMBL87072; AC1LA2PQ; SQUALESTATIN ANALOG 28 ...
MW:     692.747220 g/mol MF: C35H48O14
IUPAC name: (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetyloxy-5-methyl-3-methyl...
Create Date: 2005-08-01
CID: 460630

4512. CHEMBL87405; AC1LA2PN; SQUALESTATIN ANALOG 25 ...
MW:     580.534580 g/mol MF: C27H32O14
IUPAC name: (1S,3S,4S,5R,6R,7R)-7-acetyloxy-1-[(4S,5R)-4-acetyloxy-5-met...
Create Date: 2005-08-01
CID: 460628

4513. CHEMBL436691; AC1LA2PK; SQUALESTATIN ANALOG 23 ...
MW:     642.603960 g/mol MF: C32H34O14
IUPAC name: (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetyloxy-5-methyl-3-methyl...
Create Date: 2005-08-01
CID: 460626

4514. CHEMBL330577; AC1LA2PH; SQUALESTATIN ANALOG 22 ...
MW:     662.678180 g/mol MF: C33H42O14
IUPAC name: (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetyloxy-5-methyl-3-methyl...
Create Date: 2005-08-01
CID: 460625

4515. AC1LA2PE; SQUALESTATIN ANALOG 21; (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetoxy-5-methyl-3-methylene-6-phenyl-hexyl]-4,7-dihydroxy-6-(3-phenylprop-2-enoyloxy)-2,8-dioxabicyclo[3.2.1]octane-3,4,5-tricarboxylic acid ...
MW:     668.641240 g/mol MF: C34H36O14
IUPAC name: (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetyloxy-5-methyl-3-methyl...
Create Date: 2005-08-01
CID: 460624

4516. CHEMBL313884; AC1LA2PB; SQUALESTATIN ANALOG 20 ...
MW:     648.651600 g/mol MF: C32H40O14
IUPAC name: (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetyloxy-5-methyl-3-methyl...
Create Date: 2005-08-01
CID: 460623

4517. CHEMBL315074; AC1LA2P8; SQUALESTATIN ANALOG 19 ...
MW:     726.763440 g/mol MF: C38H46O14
IUPAC name: (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetyloxy-5-methyl-3-methyl...
Create Date: 2005-08-01
CID: 460622

4518. CHEMBL328960; AC1LA2P5; SQUALESTATIN ANALOG 18 ...
MW:     692.747220 g/mol MF: C35H48O14
IUPAC name: (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetyloxy-5-methyl-3-methyl...
Create Date: 2005-08-01
CID: 460621

4519. CHEMBL315781; AC1LA2P2; SQUALESTATIN ANALOG 17 ...
MW:     664.694060 g/mol MF: C33H44O14
IUPAC name: (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetyloxy-5-methyl-3-methyl...
Create Date: 2005-08-01
CID: 460620

4520. CHEMBL263277; AC1LA2OZ; SQUALESTATIN ANALOG 16 ...
MW:     622.614320 g/mol MF: C30H38O14
IUPAC name: (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetyloxy-5-methyl-3-methyl...
Create Date: 2005-08-01
CID: 460619

4521. CHEMBL314078; AC1LA2OW; SQUALESTATIN ANALOG 15 ...
MW:     580.534580 g/mol MF: C27H32O14
IUPAC name: (1S,3S,4S,5R,6R,7R)-6-acetyloxy-1-[(4S,5R)-4-acetyloxy-5-met...
Create Date: 2005-08-01
CID: 460618

4522. AC1L9TVZ; Haloperidol Me2NEt(Et)N analog; 4-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-1-[4-[2-dimethylaminoethyl(ethyl)amino]phenyl]butan-1-one ...
MW:     472.062520 g/mol MF: C27H38ClN3O2
IUPAC name: 4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-1-[4-[2-(dime...
Create Date: 2005-08-01
CID: 455923

4523. AC1L9RX6; Nucleocidin, 2,3-i-Pr analog; N-[9-[(3aS,4S,6R,6aR)-4-fluoro-4-(iodomethyl)-2,2-dimethyl-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxol-6-yl]purin-6-yl]-N-benzoyl-benzamide ...
MW:     643.404893 g/mol MF: C27H23FIN5O5
IUPAC name: N-[9-[(3aS,4S,6R,6aR)-4-fluoro-4-(iodomethyl)-2,2-dimethyl-6...
Create Date: 2005-08-01
CID: 454866

4524. AC1L9RUD; .alpha.-T 5'COPhCOOH analog; 2-[5-[5-(2-thienyl)-2-thienyl]thiophene-2-carbonyl]benzoic acid ...
MW:     396.502480 g/mol MF: C20H12O3S3
IUPAC name: 2-[5-(5-thiophen-2-ylthiophen-2-yl)thiophene-2-carbonyl]benz...
Create Date: 2005-08-01
CID: 454752

4525. CP-65; rac-3-Octadecanureido-2-ethoxypropyl phosphocholine; 112989-09-0 ...
MW:     579.792842 g/mol MF: C29H62N3O6P
IUPAC name: [2-ethoxy-3-(octadecylcarbamoylamino)propyl] 2-(trimethylaza...
Create Date: 2005-08-01
CID: 452628

4526. CHEMBL175198; INX; 1g7g ...
MW:     599.628880 g/mol MF: C30H37N3O10
IUPAC name: 2-(carboxymethoxy)-5-[(2S)-2-[[(2S)-2-(3-carboxypropanoylami...
Create Date: 2005-06-24
CID: 445785

4527. INZ; 1g7f; AC1L9IKF ...
MW:     543.565620 g/mol MF: C27H33N3O9
IUPAC name: 2-[4-[(2S)-2-[[(1S)-1-carboxy-2-phenylethyl]carbamoylamino]-...
Create Date: 2005-06-24
CID: 445784

4528. NSC725256; AC1L8RJZ; phenylpurine nucleoside analogue ...
MW:     288.735520 g/mol MF: C13H13ClN6
IUPAC name: 9-[[4-(chloromethyl)phenyl]methyl]purine-2,6-diamine
Create Date: 2005-03-26
CID: 406926

4529. NSC112801; MLS002706476; NSC-112801 ...
MW:     242.317900 g/mol MF: C9H10N2O2S2
IUPAC name: 2-(benzenesulfonylsulfanyl)-4,5-dihydro-1H-imidazole
Create Date: 2005-03-26
CID: 270393

4530. 1680-44-0; 4-Phenyl-1H-1,2,3-triazole; 5-phenyl-1H-1,2,3-triazole ...
MW:     145.161280 g/mol MF: C8H7N3
IUPAC name: 4-phenyl-2H-triazole
Create Date: 2005-03-26
CID: 137153

4531. Atevirdine; 136816-75-6; UNII-N24015WC6D ...
MW:     379.455500 g/mol MF: C21H25N5O2
IUPAC name: [4-[3-(ethylamino)pyridin-2-yl]piperazin-1-yl]-(5-methoxy-1H...
Create Date: 2005-08-01
CID: 60848

4532. CYANOPHOS-OXON; 61090-94-6; p-Cyanophenyl dimethyl phosphate ...
MW:     227.153762 g/mol MF: C9H10NO4P
IUPAC name: (4-cyanophenyl) dimethyl phosphate
Create Date: 2005-03-27
CID: 43545

4533. 2-Phenylbenzimidazole; 716-79-0; 2-Phenyl-1H-benzimidazole ...
MW:     194.231900 g/mol MF: C13H10N2
IUPAC name: 2-phenyl-1H-benzimidazole
Create Date: 2005-03-26
CID: 12855

4534. 21561-09-1; 6,7-dimethoxy-N-phenylquinazolin-4-amine; 6,7-dimethoxy-N-phenyl-4-quinazolinamine ...
MW:     281.309200 g/mol MF: C16H15N3O2
IUPAC name: 6,7-dimethoxy-N-phenylquinazolin-4-amine
Create Date: 2005-03-25
CID: 3798

4535. Tyrphostin AG 1478; AG-1478; 153436-53-4 ...
MW:     315.754260 g/mol MF: C16H14ClN3O2
IUPAC name: N-(3-chlorophenyl)-6,7-dimethoxyquinazolin-4-amine
Create Date: 2005-03-25
CID: 2051

4536. 115932-56-4; 4-[(diphenylcarbamoyl)oxy]-1,1-dimethylpiperidinium bromide; Piperidinium,4-[[(diphenylamino)carbonyl]oxy]-1,1-dimethyl-, bromide (1:1) ...
MW:     405.328700 g/mol MF: C20H25BrN2O2
IUPAC name: (1,1-dimethylpiperidin-1-ium-4-yl) N,N-diphenylcarbamate;bro...
Create Date: 2005-08-09
CID: 195167

4537. 6-chloro-n-(4-{[(2,4-diaminopteridin-6-yl)methyl](methyl)amino}benzoyl)-5-oxo-l-norleucine; Chloromethylketone methotrexate; AC1Q3TB1 ...
MW:     486.911520 g/mol MF: C21H23ClN8O4
IUPAC name: (2S)-6-chloro-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methyl...
Create Date: 2005-08-08
CID: 134170

4538. BDBM21030; 17-Hydroxywortmannin Analogue, 9; (2R,3S,6Z,14S,15S,17R)-6-{[tert-butyl(methyl)amino]methylidene}-8,14-dihydroxy-3-(methoxymethyl)-2,15-dimethyl-5,9-dioxo-4-oxatetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-1(10),7-dien-17-yl acetate
MW:     517.611160 g/mol MF: C28H39NO8
IUPAC name: [(1S,6Z,9S,9aS,10R,11aS)-6-[[tert-butyl(methyl)amino]methyli...
Create Date: 2015-10-06
CID: 91895939

4539. BDBM21029; 17-Hydroxywortmannin Analogue, 8; (2R,3S,6Z,14S,15S,17R)-6-{[tert-butyl(2-hydroxyethyl)amino]methylidene}-8,14-dihydroxy-3-(methoxymethyl)-2,15-dimethyl-5,9-dioxo-4-oxatetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-1(10),7-dien-17-yl acetate
MW:     547.637140 g/mol MF: C29H41NO9
IUPAC name: [(1S,6Z,9S,9aS,10R,11aS)-6-[[tert-butyl(2-hydroxyethyl)amino...
Create Date: 2015-10-06
CID: 91895938

4540. BDBM21028; 17-Hydroxywortmannin Analogue, 7; (2R,3S,6Z,14S,15S,17R)-6-[(ethylamino)methylidene]-8,14-dihydroxy-3-(methoxymethyl)-2,15-dimethyl-5,9-dioxo-4-oxatetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-1(10),7-dien-17-yl acetate
MW:     475.531420 g/mol MF: C25H33NO8
IUPAC name: [(1S,6Z,9S,9aS,10R,11aS)-6-(ethylaminomethylidene)-1-hydroxy...
Create Date: 2015-10-06
CID: 91895937

4541. BDBM21027; 17-Hydroxywortmannin Analogue, 6; (2R,3S,6Z,14S,15S,17R)-6-[(diethylamino)methylidene]-8,14,17-trihydroxy-3-(methoxymethyl)-2,15-dimethyl-4-oxatetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-1(10),7-diene-5,9-dione
MW:     461.547900 g/mol MF: C25H35NO7
IUPAC name: (1S,6Z,9S,9aS,10R,11aS)-6-(diethylaminomethylidene)-1,10-dih...
Create Date: 2015-10-06
CID: 91895936

4542. BDBM21026; 17-Hydroxywortmannin Analogue, 5; (2R,3S,6Z,14S,15S,17R)-6-[(diethylamino)methylidene]-8,14-dihydroxy-3-(methoxymethyl)-2,15-dimethyl-5,9-dioxo-4-oxatetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-1(10),7-dien-17-yl acetate
MW:     503.584580 g/mol MF: C27H37NO8
IUPAC name: [(1S,6Z,9S,9aS,10R,11aS)-6-(diethylaminomethylidene)-1-hydro...
Create Date: 2015-10-06
CID: 91895935

4543. FAGDRTQHLHVSLL-UHFFFAOYSA-N; Fentanyl, 4-N-propargyl analogue; N-(1-Propargyl-4-piperidinyl)-N-phenylpropanamide
MW:     270.369380 g/mol MF: C17H22N2O
IUPAC name: N-phenyl-N-(1-prop-2-ynylpiperidin-4-yl)propanamide
Create Date: 2015-04-28
CID: 91753695

4544. JWH 073 2-methylnapthyl analog; DRPAIIWSIJRPFH-UHFFFAOYSA-N; ZINC71746305
MW:     341.445520 g/mol MF: C24H23NO
IUPAC name: (1-butylindol-3-yl)-(2-methylnaphthalen-1-yl)methanone
Create Date: 2015-04-28
CID: 91743272

4545. UNII-HF3CYV8V6D; HF3CYV8V6D; (1-Butyl-1H-indole-3-yl)(4-methylnaphthalene-1-yl)methanone ...
MW:     341.445520 g/mol MF: C24H23NO
IUPAC name: (1-butylindol-3-yl)-(4-methylnaphthalen-1-yl)methanone
Create Date: 2015-04-28
CID: 91743259

4546. CP 47,497-para-quinone-analog; HJSQDMFICBAVFK-UHFFFAOYSA-N
MW:     332.476980 g/mol MF: C21H32O3
IUPAC name: 2-(3-hydroxycyclohexyl)-5-(2-methyloctan-2-yl)cyclohexa-2,5-...
Create Date: 2015-04-28
CID: 91691886

4547. SCHEMBL15367738; Aryl Nilutamide HDACi analog 14b; BDBM104027
MW:     569.535050 g/mol MF: C27H26F3N7O4
IUPAC name: 5-[4-[4-[[3-[4-cyano-3-(trifluoromethyl)phenyl]-5,5-dimethyl...
Create Date: 2014-02-27
CID: 72836899

4548. BDBM92408; NS3 protease inhibitor, analog 1
MW:     790.924800 g/mol MF: C40H50N6O9S
IUPAC name: (1R)-1-[[(4R)-1-[(2S)-2-(cyclopentyloxycarbonylamino)-3,3-di...
Create Date: 2013-02-27
CID: 70701991

4549. BDBM86792; Benzyl phenyl ether analogue, 6d
MW:     277.156420 g/mol MF: C14H13BrO
IUPAC name: 1-bromo-4-(2-phenoxyethyl)benzene
Create Date: 2012-07-07
CID: 57340734

4550. SCHEMBL15367740; Aryl Nilutamide HDACi analog 14f; BDBM104031
MW:     625.641370 g/mol MF: C31H34F3N7O4
IUPAC name: 9-[4-[4-[[3-[4-cyano-3-(trifluoromethyl)phenyl]-5,5-dimethyl...
Create Date: 2012-05-14
CID: 56961939

4551. SCHEMBL15362796; Aryl Nilutamide HDACi analog 14e; BDBM104030
MW:     611.614790 g/mol MF: C30H32F3N7O4
IUPAC name: 8-[4-[4-[[3-[4-cyano-3-(trifluoromethyl)phenyl]-5,5-dimethyl...
Create Date: 2012-05-14
CID: 56961887

4552. SCHEMBL15367744; Aryl Nilutamide HDACi analog 14d; BDBM104029 ...
MW:     597.588210 g/mol MF: C29H30F3N7O4
IUPAC name: 7-[4-[4-[[3-[4-cyano-3-(trifluoromethyl)phenyl]-5,5-dimethyl...
Create Date: 2012-05-14
CID: 56961886

4553. SCHEMBL15362795; Aryl Nilutamide HDACi analog 14c; BDBM104028
MW:     583.561630 g/mol MF: C28H28F3N7O4
IUPAC name: 6-[4-[4-[[3-[4-cyano-3-(trifluoromethyl)phenyl]-5,5-dimethyl...
Create Date: 2012-05-14
CID: 56961885

4554. SCHEMBL15362794; Aryl Nilutamide HDACi analog 14a; BDBM104026
MW:     555.508470 g/mol MF: C26H24F3N7O4
IUPAC name: 4-[4-[4-[[3-[4-cyano-3-(trifluoromethyl)phenyl]-5,5-dimethyl...
Create Date: 2012-05-14
CID: 56961884

4555. CHEMBL569640; BDBM35537; symmetric dicoumarol analogue, 13
MW:     392.401300 g/mol MF: C23H20O6
IUPAC name: 4-hydroxy-3-[(4-hydroxy-7,8-dimethyl-2-oxochromen-3-yl)methy...
Create Date: 2011-12-27
CID: 54736435

4556. 2H-1-Benzopyran-2-one, 3,3'-methylenebis[4-hydroxy-6-methyl-; 86739-15-3; CHEMBL569415 ...
MW:     364.348140 g/mol MF: C21H16O6
IUPAC name: 4-hydroxy-3-[(4-hydroxy-6-methyl-2-oxochromen-3-yl)methyl]-6...
Create Date: 2011-12-27
CID: 54736434

4557. CHEMBL570332; BDBM35535; symmetric dicoumarol analogue, 11
MW:     456.398900 g/mol MF: C23H20O10
IUPAC name: 4-hydroxy-3-[(4-hydroxy-6,7-dimethoxy-2-oxochromen-3-yl)meth...
Create Date: 2011-12-27
CID: 54736432

4558. CHEMBL571058; BDBM35534; symmetric dicoumarol analogue, 10 ...
MW:     392.401300 g/mol MF: C23H20O6
IUPAC name: 4-hydroxy-3-[(4-hydroxy-6,7-dimethyl-2-oxochromen-3-yl)methy...
Create Date: 2011-12-27
CID: 54736430

4559. AC1N5PLP; BDBM35536; symmetric dicoumarol analogue, 12 ...
MW:     436.412340 g/mol MF: C27H16O6
IUPAC name: 4-hydroxy-3-[(4-hydroxy-2-oxobenzo[h]chromen-3-yl)methyl]ben...
Create Date: 2011-12-26
CID: 54705236

4560. STK364544; 1821-18-7; 2H-1-Benzopyran-2-one, 3,3'-butylidenebis(4-hydroxy- ...
MW:     378.374720 g/mol MF: C22H18O6
IUPAC name: 4-hydroxy-3-[1-(4-hydroxy-2-oxochromen-3-yl)butyl]chromen-2-...
Create Date: 2011-12-26
CID: 54703981

4561. ETHYL BISCOUMACETATE; Neodicoumarin; Pelentan ...
MW:     408.357640 g/mol MF: C22H16O8
IUPAC name: ethyl 2,2-bis(4-hydroxy-2-oxochromen-3-yl)acetate
Create Date: 2011-12-26
CID: 54685524

4562. 1821-14-3; NSC402836; AC1L82GS ...
MW:     396.346940 g/mol MF: C21H16O8
IUPAC name: 4-hydroxy-3-[(4-hydroxy-7-methoxy-2-oxochromen-3-yl)methyl]-...
Create Date: 2011-12-26
CID: 54676828

4563. CHEMBL595159; SCHEMBL2982574; BDBM35862 ...
MW:     396.437900 g/mol MF: C25H20N2O3
IUPAC name: 3-[2-(2-naphthalen-2-ylethoxy)-4-(pyrazol-1-ylmethyl)phenyl]...
Create Date: 2010-01-04
CID: 44520992

4564. CHEMBL303612; N-phenyl-N''-aralkylurea analogue; BDBM50285262
MW:     404.587540 g/mol MF: C27H36N2O
IUPAC name: 1-[2,6-di(propan-2-yl)phenyl]-3-spiro[3,4-dihydro-2H-naphtha...
Create Date: 2009-11-19
CID: 44311104

4565. CHEMBL518647; BDBM30469; 3d28 ...
MW:     396.459500 g/mol MF: C21H20N2O4S
IUPAC name: (3E,5S)-1-benzyl-3-(1,1-dioxo-1,2-benzothiazol-3-ylidene)-5-...
Create Date: 2009-08-19
CID: 44143659

4566. BDBM29780; bicyclic sulfonamide analogue, 20
MW:     500.653440 g/mol MF: C26H36N4O4S
IUPAC name: N-[(2S,3R)-4-(cyclopropylamino)-3-hydroxy-1-phenylbutan-2-yl...
Create Date: 2009-08-19
CID: 44143280

4567. CHEMBL560894; BDBM29778; bicyclic sulfonamide analogue, 16
MW:     556.640710 g/mol MF: C26H35F3N4O4S
IUPAC name: 6-(ethylamino)-N-[(2S,3R)-3-hydroxy-1-phenyl-4-(3,3,3-triflu...
Create Date: 2009-08-19
CID: 44143278

4568. CHEMBL564712; BDBM29776; bicyclic sulfonamide analogue, 14
MW:     544.706000 g/mol MF: C28H40N4O5S
IUPAC name: 6-(ethylamino)-N-[(2S,3R)-3-hydroxy-4-(oxan-4-ylamino)-1-phe...
Create Date: 2009-08-19
CID: 44143276

4569. CHEMBL560497; SCHEMBL5219355; BDBM29774 ...
MW:     544.706000 g/mol MF: C28H40N4O5S
IUPAC name: 3-(1,1-dioxothiazinan-2-yl)-5-(ethylamino)-N-[(2S,3R)-3-hydr...
Create Date: 2009-08-19
CID: 44143275

4570. CHEMBL553699; BDBM29773; bicyclic sulfonamide analogue, 11
MW:     618.710090 g/mol MF: C31H37F3N4O4S
IUPAC name: 6-(ethylamino)-N-[(2S,3R)-3-hydroxy-1-phenyl-4-[[3-(trifluor...
Create Date: 2009-08-19
CID: 44143274

4571. CHEMBL1186946; BDBM29071; amine-based bicyclic analogue, 13
MW:     422.298466 g/mol MF: C21H19Cl2F2N3
IUPAC name: 2-(2-chlorophenyl)-3-(4-chlorophenyl)-6-(2,2-difluoropropyl)...
Create Date: 2009-06-25
CID: 42617981

4572. CHEMBL483873; BDBM28905; 3-mercaptopropionamide analog, 5 ...
MW:     281.761180 g/mol MF: C12H12ClN3OS
IUPAC name: N-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-3-sulfanylpropanamide
Create Date: 2009-05-20
CID: 25263435

4573. CHEMBL518754; BDBM24298; Modified amino acid analog, 12h ...
MW:     429.467820 g/mol MF: C25H23N3O4
IUPAC name: (4S)-4-amino-5-(1,3-dioxoisoindol-2-yl)-N-(4-phenoxyphenyl)p...
Create Date: 2008-09-22
CID: 24901643

4574. CHEMBL479216; BDBM24297; Modified amino acid analog, 12g ...
MW:     349.426220 g/mol MF: C21H23N3O2
IUPAC name: (4S)-4-amino-N-(4-phenoxyphenyl)-5-pyrrol-1-ylpentanamide
Create Date: 2008-09-22
CID: 24901642

4575. CHEMBL479215; BDBM24296; Modified amino acid analog, 12f ...
MW:     415.532340 g/mol MF: C19H21N5O2S2
IUPAC name: (4S)-4-amino-5-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(...
Create Date: 2008-09-22
CID: 24901641

4576. CHEMBL479217; BDBM24295; Modified amino acid analog, 12e ...
MW:     337.375760 g/mol MF: C18H19N5O2
IUPAC name: (4S)-4-amino-N-(4-phenoxyphenyl)-4-(1H-1,2,4-triazol-5-yl)bu...
Create Date: 2008-09-22
CID: 24901640

4577. CHEMBL477277; BDBM24294; Modified amino acid analog, 12d ...
MW:     364.416100 g/mol MF: C17H20N2O5S
IUPAC name: (2S)-2-amino-5-oxo-5-(4-phenoxyanilino)pentane-1-sulfonic ac...
Create Date: 2008-09-22
CID: 24901639

4578. CHEMBL477276; BDBM24293; Modified amino acid analog, 12c ...
MW:     314.378880 g/mol MF: C18H22N2O3
IUPAC name: (4S)-4-amino-5-methoxy-N-(4-phenoxyphenyl)pentanamide
Create Date: 2008-09-22
CID: 24901638

4579. CHEMBL477275; BDBM24292; Modified amino acid analog, 12b ...
MW:     299.367540 g/mol MF: C17H21N3O2
IUPAC name: (4S)-4,5-diamino-N-(4-phenoxyphenyl)pentanamide
Create Date: 2008-09-22
CID: 24901637

4580. CHEMBL516418; BDBM24291; Modified amino acid analog, 12a ...
MW:     300.352300 g/mol MF: C17H20N2O3
IUPAC name: (4S)-4-amino-5-hydroxy-N-(4-phenoxyphenyl)pentanamide
Create Date: 2008-09-22
CID: 24901636

4581. CHEMBL508528; BDBM24290; Modified amino acid analog, 11e ...
MW:     356.418860 g/mol MF: C19H24N4O3
IUPAC name: (2S)-2-amino-N-(2-aminoethyl)-N'-(4-phenoxyphenyl)pentanedia...
Create Date: 2008-09-22
CID: 24901635

4582. CHEMBL517048; BDBM24289; Modified amino acid analog, 11d ...
MW:     357.403620 g/mol MF: C19H23N3O4
IUPAC name: (2S)-2-amino-N-(2-hydroxyethyl)-N'-(4-phenoxyphenyl)pentaned...
Create Date: 2008-09-22
CID: 24901634

4583. CHEMBL514552; BDBM24288; Modified amino acid analog, 11c ...
MW:     399.440300 g/mol MF: C21H25N3O5
IUPAC name: 4-[[(2S)-2-amino-5-oxo-5-(4-phenoxyanilino)pentanoyl]amino]b...
Create Date: 2008-09-22
CID: 24901633

4584. CHEMBL478995; BDBM24287; Modified amino acid analog, 11b ...
MW:     385.413720 g/mol MF: C20H23N3O5
IUPAC name: 3-[[(2S)-2-amino-5-oxo-5-(4-phenoxyanilino)pentanoyl]amino]p...
Create Date: 2008-09-22
CID: 24901632

4585. CHEMBL478994; BDBM24286; Modified amino acid analog, 11a ...
MW:     371.387140 g/mol MF: C19H21N3O5
IUPAC name: 2-[[(2S)-2-amino-5-oxo-5-(4-phenoxyanilino)pentanoyl]amino]a...
Create Date: 2008-09-22
CID: 24901631

4586. CHEMBL236162; BDBM23525; Biaryl Anthranilide Analogue, 2g ...
MW:     402.851400 g/mol MF: C19H15ClN2O4S
IUPAC name: 2-[3-[(2Z)-2-(2-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)-3H...
Create Date: 2008-07-30
CID: 24860431

4587. SCHEMBL8249394; BDBM21488; Amino dicarboxylate analogue, 15 ...
MW:     387.472660 g/mol MF: C21H29N3O4
IUPAC name: (2S)-2-[[(1S)-1-carboxy-2-[3-[(3,5-dimethylphenyl)methyl]imi...
Create Date: 2008-05-08
CID: 24776247

4588. BDBM21487; Amino dicarboxylate analogue, 14; N-[(S)-1-Carboxy-2-[1-(3,4-dimethylbenzyl)-1H-imidazole-5-yl]ethyl]-L-leucine ...
MW:     387.472660 g/mol MF: C21H29N3O4
IUPAC name: (2S)-2-[[(1S)-1-carboxy-2-[3-[(3,4-dimethylphenyl)methyl]imi...
Create Date: 2008-05-08
CID: 24776246

4589. BDBM21486; Amino dicarboxylate analogue, 13; N-[(S)-1-Carboxy-2-[1-(3-methylbenzyl)-1H-imidazole-5-yl]ethyl]-L-leucine ...
MW:     373.446080 g/mol MF: C20H27N3O4
IUPAC name: (2S)-2-[[(1S)-1-carboxy-2-[3-[(3-methylphenyl)methyl]imidazo...
Create Date: 2008-05-08
CID: 24776245

4590. BDBM21485; Amino dicarboxylate analogue, 12; N-[(S)-1-Carboxy-2-[1-(2-methylbenzyl)-1H-imidazole-5-yl]ethyl]-L-leucine ...
MW:     373.446080 g/mol MF: C20H27N3O4
IUPAC name: (2S)-2-[[(1S)-1-carboxy-2-[3-[(2-methylphenyl)methyl]imidazo...
Create Date: 2008-05-08
CID: 24776244

4591. BDBM21484; Amino dicarboxylate analogue, 11; N-[(S)-1-Carboxy-2-[1-(4-methylbenzyl)-1H-imidazole-5-yl]ethyl]-L-leucine ...
MW:     373.446080 g/mol MF: C20H27N3O4
IUPAC name: (2S)-2-[[(1S)-1-carboxy-2-[3-[(4-methylphenyl)methyl]imidazo...
Create Date: 2008-05-08
CID: 24776243

4592. BDBM21483; Amino dicarboxylate analogue, 10; N-[(S)-1-Carboxy-2-[1-[4-(trifluoromethoxy)benzyl]-1H-imidazole-5-yl]ethyl]-L-leucine ...
MW:     443.416870 g/mol MF: C20H24F3N3O5
IUPAC name: (2S)-2-[[(1S)-1-carboxy-2-[3-[[4-(trifluoromethoxy)phenyl]me...
Create Date: 2008-05-08
CID: 24776242

4593. BDBM21240; 2-mercaptopyrimidine analogue, 5s; N-[2-(tert-butylsulfanyl)-6-[(4-chlorophenyl)methoxy]pyrimidin-4-yl]acetamide
MW:     365.877600 g/mol MF: C17H20ClN3O2S
IUPAC name: N-[2-tert-butylsulfanyl-6-[(4-chlorophenyl)methoxy]pyrimidin...
Create Date: 2008-04-23
CID: 24768453

4594. CHEMBL272795; BDBM21239; 2-mercaptopyrimidine analogue, 5r ...
MW:     337.824440 g/mol MF: C15H16ClN3O2S
IUPAC name: N-[6-[(4-chlorophenyl)methoxy]-2-ethylsulfanylpyrimidin-4-yl...
Create Date: 2008-04-23
CID: 24768452

4595. CHEMBL256643; BDBM21238; 2-mercaptopyrimidine analogue, 5q ...
MW:     323.453600 g/mol MF: C16H25N3O2S
IUPAC name: N-[6-(cyclohexylmethoxy)-2-propylsulfanylpyrimidin-4-yl]acet...
Create Date: 2008-04-23
CID: 24768451

4596. CHEMBL429131; BDBM21237; 2-mercaptopyrimidine analogue, 5p ...
MW:     331.432540 g/mol MF: C17H21N3O2S
IUPAC name: N-[6-(2-phenylethoxy)-2-propylsulfanylpyrimidin-4-yl]acetami...
Create Date: 2008-04-23
CID: 24768450

4597. CHEMBL402848; BDBM21236; 2-mercaptopyrimidine analogue, 5o ...
MW:     347.431940 g/mol MF: C17H21N3O3S
IUPAC name: N-[6-[(4-methoxyphenyl)methoxy]-2-propylsulfanylpyrimidin-4-...
Create Date: 2008-04-23
CID: 24768449

4598. CHEMBL406567; BDBM21235; 2-mercaptopyrimidine analogue, 5n ...
MW:     386.296080 g/mol MF: C16H17Cl2N3O2S
IUPAC name: N-[6-[(2,4-dichlorophenyl)methoxy]-2-propylsulfanylpyrimidin...
Create Date: 2008-04-23
CID: 24768448

4599. CHEMBL270676; BDBM21234; 2-mercaptopyrimidine analogue, 5m ...
MW:     351.851020 g/mol MF: C16H18ClN3O2S
IUPAC name: N-[6-[(4-chlorophenyl)methoxy]-2-propylsulfanylpyrimidin-4-y...
Create Date: 2008-04-23
CID: 24768447

4600. CHEMBL257256; BDBM21233; 2-mercaptopyrimidine analogue, 5l ...
MW:     351.851020 g/mol MF: C16H18ClN3O2S
IUPAC name: N-[6-[(3-chlorophenyl)methoxy]-2-propylsulfanylpyrimidin-4-y...
Create Date: 2008-04-23
CID: 24768446

4601. CHEMBL271106; BDBM21232; 2-mercaptopyrimidine analogue, 5k ...
MW:     351.851020 g/mol MF: C16H18ClN3O2S
IUPAC name: N-[6-[(2-chlorophenyl)methoxy]-2-propylsulfanylpyrimidin-4-y...
Create Date: 2008-04-23
CID: 24768445

4602. CHEMBL257487; BDBM21231; 2-mercaptopyrimidine analogue, 5j ...
MW:     317.405960 g/mol MF: C16H19N3O2S
IUPAC name: N-(6-phenylmethoxy-2-propylsulfanylpyrimidin-4-yl)acetamide
Create Date: 2008-04-23
CID: 24768444

4603. CHEMBL257298; BDBM21230; 2-mercaptopyrimidine analogue, 5i ...
MW:     317.405960 g/mol MF: C16H19N3O2S
IUPAC name: N-(2-benzylsulfanyl-6-propoxypyrimidin-4-yl)acetamide
Create Date: 2008-04-23
CID: 24768443

4604. CHEMBL271753; BDBM21229; 2-mercaptopyrimidine analogue, 5h ...
MW:     283.389740 g/mol MF: C13H21N3O2S
IUPAC name: N-(6-propoxy-2-propylsulfanylpyrimidin-4-yl)propanamide
Create Date: 2008-04-23
CID: 24768442

4605. CHEMBL272596; BDBM21228; 2-mercaptopyrimidine analogue, 5g ...
MW:     269.363160 g/mol MF: C12H19N3O2S
IUPAC name: N-(6-propoxy-2-propylsulfanylpyrimidin-4-yl)acetamide
Create Date: 2008-04-23
CID: 24768441

4606. CHEMBL429435; BDBM21227; 2-mercaptopyrimidine analogue, 5f ...
MW:     255.336580 g/mol MF: C11H17N3O2S
IUPAC name: N-(6-methoxy-2-propylsulfanylpyrimidin-4-yl)propanamide
Create Date: 2008-04-23
CID: 24768440

4607. CHEMBL405824; BDBM21226; 2-mercaptopyrimidine analogue, 5e ...
MW:     241.310000 g/mol MF: C10H15N3O2S
IUPAC name: N-(6-methoxy-2-propylsulfanylpyrimidin-4-yl)acetamide
Create Date: 2008-04-23
CID: 24768439

4608. CHEMBL406727; BDBM21225; 2-mercaptopyrimidine analogue, 5d ...
MW:     255.336580 g/mol MF: C11H17N3O2S
IUPAC name: N-(2-methylsulfanyl-6-propoxypyrimidin-4-yl)propanamide
Create Date: 2008-04-23
CID: 24768438

4609. CHEMBL272174; BDBM21224; 2-mercaptopyrimidine analogue, 5c ...
MW:     241.310000 g/mol MF: C10H15N3O2S
IUPAC name: N-(2-methylsulfanyl-6-propoxypyrimidin-4-yl)acetamide
Create Date: 2008-04-23
CID: 24768437

4610. CHEMBL272173; BDBM21223; 2-mercaptopyrimidine analogue, 5b ...
MW:     227.283420 g/mol MF: C9H13N3O2S
IUPAC name: N-(6-methoxy-2-methylsulfanylpyrimidin-4-yl)propanamide
Create Date: 2008-04-23
CID: 24768436

4611. 6-acetamiddo-4-methoxy-2-methylthiopyrimidine; 98594-55-9; CHEMBL270708 ...
MW:     213.256840 g/mol MF: C8H11N3O2S
IUPAC name: N-(6-methoxy-2-methylsulfanylpyrimidin-4-yl)acetamide
Create Date: 2008-04-23
CID: 24768435

4612. SCHEMBL12671648; BDBM23533; Biaryl Anthranilide Analogue, 2o ...
MW:     354.316860 g/mol MF: C17H14N4O5
IUPAC name: 2-[3-[(3Z)-3-(5-oxopyridin-2-ylidene)-1,2,4-oxadiazol-5-yl]p...
Create Date: 2008-03-03
CID: 24741414

4613. CHEMBL237036; BDBM23529; Biaryl Anthranilide Analogue, 2k ...
MW:     358.371760 g/mol MF: C16H14N4O4S
IUPAC name: 2-[3-[2-(4-hydroxypyrazol-1-yl)-1,3-thiazol-5-yl]propanoylam...
Create Date: 2008-03-03
CID: 24741312

4614. 2-(3-(3-(4-hydroxyphenyl)-1,2,4-oxadiazol-5-yl)propanamido)benzoic acid; 2-{3-[3-(4-hydroxyphenyl)-1,2,4-oxadiazol-5-yl]propanamido}benzoic acid; CHEMBL391813 ...
MW:     353.328800 g/mol MF: C18H15N3O5
IUPAC name: 2-[3-[3-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,2,4-oxadiazol-...
Create Date: 2008-03-03
CID: 24741311

4615. CHEMBL237543; BDBM23532; Biaryl Anthranilide Analogue, 2n ...
MW:     352.344040 g/mol MF: C18H16N4O4
IUPAC name: 2-[3-[1-(5-hydroxypyridin-2-yl)pyrazol-3-yl]propanoylamino]b...
Create Date: 2008-03-03
CID: 24741310

4616. CHEMBL237037; BDBM23530; Biaryl Anthranilide Analogue, 2l ...
MW:     369.394400 g/mol MF: C18H15N3O4S
IUPAC name: 2-[3-[(2Z)-2-(5-oxopyridin-2-ylidene)-3H-1,3-thiazol-5-yl]pr...
Create Date: 2008-03-03
CID: 24741309

4617. CHEMBL236164; BDBM23528; Biaryl Anthranilide Analogue, 2j ...
MW:     353.328800 g/mol MF: C18H15N3O5
IUPAC name: 2-[3-[2-(4-oxocyclohexa-2,5-dien-1-ylidene)-3H-1,3,4-oxadiaz...
Create Date: 2008-03-03
CID: 24741308

4618. CHEMBL236163; BDBM23526; Biaryl Anthranilide Analogue, 2h ...
MW:     365.382560 g/mol MF: C20H19N3O4
IUPAC name: 2-[3-[1-(4-hydroxyphenyl)-5-methylpyrazol-4-yl]propanoylamin...
Create Date: 2008-03-03
CID: 24741307

4619. CHEMBL428724; BDBM23523; Biaryl Anthranilide Analogue, 2e ...
MW:     334.368520 g/mol MF: C20H18N2O3
IUPAC name: 2-[3-[4-(1H-pyrrol-2-yl)phenyl]propanoylamino]benzoic acid
Create Date: 2008-03-03
CID: 24741306

4620. CHEMBL517365; SCHEMBL2113248; BDBM30332 ...
MW:     532.413920 g/mol MF: C30H23Cl2NO4
IUPAC name: 7-[4-[[3-(2,6-dichlorophenyl)-5-propan-2-yl-1,2-oxazol-4-yl]...
Create Date: 2008-03-03
CID: 24739173

4621. CHEMBL514398; SCHEMBL2114048; BDBM30331 ...
MW:     532.413920 g/mol MF: C30H23Cl2NO4
IUPAC name: 7-[4-[[3-(2,6-dichlorophenyl)-5-propan-2-yl-1,2-oxazol-4-yl]...
Create Date: 2008-03-03
CID: 24739171

4622. CHEMBL515776; SCHEMBL2114897; BDBM30330 ...
MW:     532.413920 g/mol MF: C30H23Cl2NO4
IUPAC name: 6-[4-[[3-(2,6-dichlorophenyl)-5-propan-2-yl-1,2-oxazol-4-yl]...
Create Date: 2008-03-03
CID: 24739170

4623. BDBM19159; chlamydocin-methylketone analog, 5; (3S,9S,14aR)-9-benzyl-6,6-dimethyl-3-(6-oxoheptyl)-tetradecahydropyrrolo[1,2-a][,,,]cyclododecane-1,4,7,10-tetrone
MW:     498.614420 g/mol MF: C27H38N4O5
IUPAC name: (3S,9S,12R)-3-benzyl-6,6-dimethyl-9-(6-oxoheptyl)-1,4,7,10-t...
Create Date: 2008-01-19
CID: 23648191

4624. CHEMBL212549; BDBM17061; Dihydro-quinazolinone analog, 10 ...
MW:     530.436286 g/mol MF: C28H27Cl2F2N3O
IUPAC name: 1-(2,6-dichlorophenyl)-5-(2,4-difluorophenyl)-7-(1-propan-2-...
Create Date: 2008-01-19
CID: 23647628

4625. CHEMBL383217; BDBM14947; 5-amidino benzimidazole analog 58
MW:     500.545720 g/mol MF: C28H28N4O5
IUPAC name: 2-[(3E)-5-(4-tert-butylphenyl)-3-(5-carbamimidoyl-1,3-dihydr...
Create Date: 2008-01-19
CID: 23646930

4626. CHEMBL378607; BDBM14946; 5-amidino benzimidazole analog 57 ...
MW:     368.343440 g/mol MF: C18H16N4O5
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646929

4627. CHEMBL203825; SCHEMBL6396487; BDBM14945 ...
MW:     486.476080 g/mol MF: C26H22N4O6
IUPAC name: 2-[(3E)-5-(2-acetylphenyl)-3-(5-carbamimidoyl-1,3-dihydroben...
Create Date: 2008-01-19
CID: 23646928

4628. CHEMBL381702; BDBM14944; 5-amidino benzimidazole analog 55 ...
MW:     474.465380 g/mol MF: C25H22N4O6
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646927

4629. CHEMBL205880; BDBM14943; 5-amidino benzimidazole analog 54 ...
MW:     460.438800 g/mol MF: C24H20N4O6
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646926

4630. CHEMBL202784; BDBM14942; 5-amidino benzimidazole analog 53 ...
MW:     473.480620 g/mol MF: C25H23N5O5
IUPAC name: 2-[(3E)-5-[3-(aminomethyl)phenyl]-3-(5-carbamimidoyl-1,3-dih...
Create Date: 2008-01-19
CID: 23646925

4631. CHEMBL438973; SCHEMBL6392183; BDBM14941 ...
MW:     474.465380 g/mol MF: C25H22N4O6
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646924

4632. CHEMBL204228; BDBM14940; 5-amidino benzimidazole analog 51 ...
MW:     445.427460 g/mol MF: C23H19N5O5
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646923

4633. CHEMBL204283; SCHEMBL7258366; BDBM14939 ...
MW:     458.465980 g/mol MF: C25H22N4O5
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646922

4634. CHEMBL206337; BDBM14938; 5-amidino benzimidazole analog 49 ...
MW:     478.884460 g/mol MF: C24H19ClN4O5
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646921

4635. CHEMBL205771; BDBM14937; 5-amidino benzimidazole analog 48 ...
MW:     458.465980 g/mol MF: C25H22N4O5
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646920

4636. CHEMBL383431; SCHEMBL7258359; BDBM14936 ...
MW:     459.454040 g/mol MF: C24H21N5O5
IUPAC name: 2-[(3E)-5-(2-aminophenyl)-3-(5-carbamimidoyl-1,3-dihydrobenz...
Create Date: 2008-01-19
CID: 23646919

4637. CHEMBL204159; SCHEMBL7256399; BDBM14935 ...
MW:     492.455843 g/mol MF: C25H21FN4O6
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646918

4638. CHEMBL202799; SCHEMBL6389971; BDBM14934 ...
MW:     499.474840 g/mol MF: C26H21N5O6
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646917

4639. BDBM14933; 5-amidino benzimidazole analog 44; 2-[3-(5-carbamimidoyl-1H-1,3-benzodiazol-2-yl)-4-hydroxy-5-[3-(2-oxo-1,3-dioxan-4-yl)phenyl]phenyl]butanedioic acid
MW:     544.512160 g/mol MF: C28H24N4O8
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646916

4640. CHEMBL206429; SCHEMBL7253498; BDBM14932 ...
MW:     513.329520 g/mol MF: C24H18Cl2N4O5
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646915

4641. CHEMBL379018; SCHEMBL7253501; BDBM14931 ...
MW:     513.329520 g/mol MF: C24H18Cl2N4O5
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646914

4642. CHEMBL382157; SCHEMBL7258057; BDBM14930 ...
MW:     547.774580 g/mol MF: C24H17Cl3N4O5
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646913

4643. CHEMBL203008; SCHEMBL7253187; BDBM14929 ...
MW:     462.429863 g/mol MF: C24H19FN4O5
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646912

4644. BDBM14928; 5-amidino benzimidazole analog 39; 2-[3-(5-carbamimidoyl-1H-1,3-benzodiazol-2-yl)-4-hydroxy-5-[5-(hydroxymethyl)thiophen-2-yl]phenyl]butanedioic acid
MW:     480.493100 g/mol MF: C23H20N4O6S
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646911

4645. CHEMBL381120; SCHEMBL7256414; BDBM14927 ...
MW:     474.465380 g/mol MF: C25H22N4O6
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646910

4646. CHEMBL202850; BDBM14926; 5-amidino benzimidazole analog 37 ...
MW:     496.874923 g/mol MF: C24H18ClFN4O5
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646909

4647. CHEMBL377953; BDBM14923; 5-amidino benzimidazole analog 34 ...
MW:     501.490720 g/mol MF: C26H23N5O6
IUPAC name: 2-[(3E)-5-(3-acetamidophenyl)-3-(5-carbamimidoyl-1,3-dihydro...
Create Date: 2008-01-19
CID: 23646908

4648. BDBM14922; 5-amidino benzimidazole analog 33; 2-[3-(5-carbamimidoyl-1H-1,3-benzodiazol-2-yl)-5-(5-chlorothiophen-2-yl)-4-hydroxyphenyl]butanedioic acid
MW:     484.912180 g/mol MF: C22H17ClN4O5S
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646907

4649. CHEMBL382418; SCHEMBL6395167; BDBM14921 ...
MW:     460.438800 g/mol MF: C24H20N4O6
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646906

4650. CHEMBL205128; SCHEMBL6392698; BDBM14920 ...
MW:     469.448860 g/mol MF: C25H19N5O5
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646905

4651. CHEMBL377080; SCHEMBL7256455; BDBM14919 ...
MW:     486.519140 g/mol MF: C27H26N4O5
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646904

4652. CHEMBL206330; SCHEMBL7253480; BDBM14918 ...
MW:     480.420326 g/mol MF: C24H18F2N4O5
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646903

4653. CHEMBL203055; SCHEMBL7258122; BDBM14917 ...
MW:     478.884460 g/mol MF: C24H19ClN4O5
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646902

4654. SCHEMBL7256426; BDBM14916; 5-amidino benzimidazole analog 27 ...
MW:     490.530980 g/mol MF: C25H22N4O5S
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646901

4655. BDBM14915; 5-amidino benzimidazole analog 26; 2-[3-(5-carbamimidoyl-1H-1,3-benzodiazol-2-yl)-4-hydroxy-5-[N-(3-methylphenyl)acetamido]phenyl]butanedioic acid
MW:     515.517300 g/mol MF: C27H25N5O6
IUPAC name: 2-[(3E)-5-(N-acetyl-3-methylanilino)-3-(5-carbamimidoyl-1,3-...
Create Date: 2008-01-19
CID: 23646900

4656. CHEMBL205208; SCHEMBL7258358; BDBM14914 ...
MW:     458.465980 g/mol MF: C25H22N4O5
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646899

4657. CHEMBL203046; SCHEMBL7252686; BDBM14913 ...
MW:     459.454040 g/mol MF: C24H21N5O5
IUPAC name: 2-[(3E)-5-(3-aminophenyl)-3-(5-carbamimidoyl-1,3-dihydrobenz...
Create Date: 2008-01-19
CID: 23646898

4658. CHEMBL379906; SCHEMBL6388048; BDBM14912 ...
MW:     486.476080 g/mol MF: C26H22N4O6
IUPAC name: 2-[(3E)-5-(3-acetylphenyl)-3-(5-carbamimidoyl-1,3-dihydroben...
Create Date: 2008-01-19
CID: 23646897

4659. CHEMBL206539; BDBM14911; 5-amidino benzimidazole analog 22 ...
MW:     472.492560 g/mol MF: C26H24N4O5
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646896

4660. CHEMBL379671; BDBM14910; 5-amidino benzimidazole analog 21 ...
MW:     513.329520 g/mol MF: C24H18Cl2N4O5
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646895

4661. CHEMBL202807; SCHEMBL6396243; BDBM14906 ...
MW:     529.328920 g/mol MF: C24H18Cl2N4O6
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646893

4662. CHEMBL203728; SCHEMBL6390100; BDBM14905 ...
MW:     529.328920 g/mol MF: C24H18Cl2N4O6
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646892

4663. CHEMBL383639; SCHEMBL6390056; BDBM14904 ...
MW:     573.779920 g/mol MF: C24H18BrClN4O6
IUPAC name: 2-[(3E)-5-(3-bromo-5-chloro-2-hydroxyphenyl)-3-(5-carbamimid...
Create Date: 2008-01-19
CID: 23646891

4664. CHEMBL444622; SCHEMBL6392530; BDBM14903 ...
MW:     460.438800 g/mol MF: C24H20N4O6
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646890

4665. CHEMBL206507; SCHEMBL6393987; BDBM14902 ...
MW:     485.448260 g/mol MF: C25H19N5O6
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646889

4666. CHEMBL383269; SCHEMBL6390449; BDBM14901 ...
MW:     475.453440 g/mol MF: C24H21N5O6
IUPAC name: 2-[(3E)-5-(5-amino-2-hydroxyphenyl)-3-(5-carbamimidoyl-1,3-d...
Create Date: 2008-01-19
CID: 23646888

4667. CHEMBL426675; SCHEMBL6392174; BDBM14900 ...
MW:     505.436360 g/mol MF: C24H19N5O8
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646887

4668. CHEMBL206234; SCHEMBL6395115; BDBM14899 ...
MW:     494.883860 g/mol MF: C24H19ClN4O6
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646886

4669. CHEMBL377082; SCHEMBL6392464; BDBM14898 ...
MW:     478.429263 g/mol MF: C24H19FN4O6
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2008-01-19
CID: 23646885

4670. CHEMBL185872; BDBM13995; Isoxazole carboxylic acid analog 6 ...
MW:     421.399460 g/mol MF: C23H19NO7
IUPAC name: 8-[(E)-3-(3-hydroxy-2-methoxycarbonylphenoxy)prop-1-enyl]-4,...
Create Date: 2008-01-19
CID: 23646574

4671. CHEMBL363229; BDBM13992; Isoxazole carboxylic acid analog 3 ...
MW:     413.377460 g/mol MF: C21H19NO8
IUPAC name: 5-[3-[2-hydroxy-3-(3-hydroxy-2-methoxycarbonylphenoxy)propyl...
Create Date: 2008-01-19
CID: 23646573

4672. CHEMBL361485; BDBM13991; Isoxazole carboxylic acid analog 2 ...
MW:     412.349640 g/mol MF: C20H16N2O8
IUPAC name: 5-[3-[[2-(3-hydroxy-2-methoxycarbonylphenoxy)acetyl]amino]ph...
Create Date: 2008-01-19
CID: 23646572

4673. CHEMBL190208; BDBM9898; 2-thioazole isoflavone analog 3d ...
MW:     351.379120 g/mol MF: C18H13N3O3S
IUPAC name: 7-methoxy-3-phenyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)chromen-...
Create Date: 2008-01-19
CID: 23644938

4674. BDBM9897; CHEMBL190848; 2-thioazole isoflavone analog 3c ...
MW:     364.417640 g/mol MF: C20H16N2O3S
IUPAC name: 7-methoxy-2-(1-methylimidazol-2-yl)sulfanyl-3-phenylchromen-...
Create Date: 2008-01-19
CID: 23644937

4675. CHEMBL191488; BDBM9896; 2-thioazole isoflavone analog 3b ...
MW:     350.391060 g/mol MF: C19H14N2O3S
IUPAC name: 2-(1H-imidazol-2-ylsulfanyl)-7-methoxy-3-phenylchromen-4-one
Create Date: 2008-01-19
CID: 23644936

4676. CHEMBL235710; SCHEMBL17708328; BDBM19022 ...
MW:     433.459820 g/mol MF: C23H23N5O4
IUPAC name: 6-[4-[acetyl(methyl)amino]phenyl]-1-(4-methoxyphenyl)-7-oxo-...
Create Date: 2008-01-07
CID: 23635500

4677. CHEMBL595157; SCHEMBL2978788; BDBM35864 ...
MW:     414.496240 g/mol MF: C26H26N2O3
IUPAC name: 4-[2-(2-naphthalen-2-ylethoxy)-4-(pyrazol-1-ylmethyl)phenyl]...
Create Date: 2007-12-05
CID: 23017362

4678. CHEMBL595830; SCHEMBL2971757; BDBM35865 ...
MW:     416.469060 g/mol MF: C25H24N2O4
IUPAC name: 2-[[2-(2-naphthalen-2-ylethoxy)-4-(pyrazol-1-ylmethyl)phenyl...
Create Date: 2007-12-05
CID: 23017109

4679. CHEMBL503605; SCHEMBL6130879; BDBM26391 ...
MW:     263.722760 g/mol MF: C13H14ClN3O
IUPAC name: (5-chloro-1H-indol-2-yl)-piperazin-1-ylmethanone
Create Date: 2007-12-05
CID: 21638785

4680. SCHEMBL8029041; BDBM93375; PSTQ Analog, 3{12,21} ...
MW:     443.906620 g/mol MF: C20H18ClN5O3S
IUPAC name: 3-(benzenesulfonyl)-7-chloro-N-(oxolan-2-ylmethyl)triazolo[1...
Create Date: 2007-12-05
CID: 20878619

4681. BDBM93384; PSTQ Analog, 3{10,33}; MolPort-007-662-088 ...
MW:     473.546820 g/mol MF: C25H23N5O3S
IUPAC name: N-(3-methoxyphenyl)-3-(2,4,6-trimethylphenyl)sulfonyltriazol...
Create Date: 2007-12-05
CID: 20878573

4682. SCHEMBL8019291; BDBM93374; PSTQ Analog, 3{10,21} ...
MW:     451.541300 g/mol MF: C23H25N5O3S
IUPAC name: N-(oxolan-2-ylmethyl)-3-(2,4,6-trimethylphenyl)sulfonyltriaz...
Create Date: 2007-12-05
CID: 20878542

4683. CHEMBL375461; BDBM20564; Piperazinylpyrimidine analogue, 15 ...
MW:     371.413580 g/mol MF: C17H17N5O3S
IUPAC name: N-[4-(6-morpholin-4-ylpyrimidin-4-yl)oxy-1,3-benzothiazol-2-...
Create Date: 2007-10-15
CID: 16748467

4684. CHEMBL229432; BDBM20563; Piperazinylpyrimidine analogue, 14 ...
MW:     437.438730 g/mol MF: C19H18F3N5O2S
IUPAC name: N-[4-[6-[4-(trifluoromethyl)piperidin-1-yl]pyrimidin-4-yl]ox...
Create Date: 2007-10-15
CID: 16748466

4685. CHEMBL375460; SCHEMBL4017022; SCHEMBL4020853 ...
MW:     436.450670 g/mol MF: C20H19F3N4O2S
IUPAC name: N-[4-[6-[4-(trifluoromethyl)cyclohexyl]pyrimidin-4-yl]oxy-1,...
Create Date: 2007-10-15
CID: 16748465

4686. CHEMBL229431; SCHEMBL4015444; BDBM20561 ...
MW:     434.434790 g/mol MF: C20H17F3N4O2S
IUPAC name: N-[4-[6-[4-(trifluoromethyl)cyclohexen-1-yl]pyrimidin-4-yl]o...
Create Date: 2007-10-15
CID: 16748464

4687. CHEBI:39086; linkable Ro-320-1195 analogue; [5-amino-1-(4-fluorophenyl)-1H-pyrazol-4-yl][3-(3-amino-2-hydroxypropoxy)phenyl]methanone
MW:     370.377563 g/mol MF: C19H19FN4O3
IUPAC name: [5-amino-1-(4-fluorophenyl)pyrazol-4-yl]-[3-(3-amino-2-hydro...
Create Date: 2007-08-31
CID: 16722148

4688. CHEMBL448483; SCHEMBL1690399; BDBM13752 ...
MW:     320.305793 g/mol MF: C13H12F4N2OS
IUPAC name: 2-[[(1S)-1-(2-fluorophenyl)ethyl]amino]-5-methyl-5-(trifluor...
Create Date: 2007-08-09
CID: 16655110

4689. UNII-37IS6K16XE; GSK-8062; 37IS6K16XE ...
MW:     532.413920 g/mol MF: C30H23Cl2NO4
IUPAC name: 6-[4-[[3-(2,6-dichlorophenyl)-5-propan-2-yl-1,2-oxazol-4-yl]...
Create Date: 2007-07-16
CID: 16214849

4690. CHEMBL438654; SCHEMBL15267926; BDBM13751 ...
MW:     312.378026 g/mol MF: C15H18F2N2OS
IUPAC name: 2-[[(1S)-1-(2-fluorophenyl)ethyl]amino]-5-(2-fluoropropan-2-...
Create Date: 2007-06-18
CID: 16105498

4691. CHEMBL221477; SCHEMBL1604489; BDBM13750 ...
MW:     294.387563 g/mol MF: C15H19FN2OS
IUPAC name: (5R)-2-[[(1S)-1-(2-fluorophenyl)ethyl]amino]-5-methyl-5-prop...
Create Date: 2007-06-18
CID: 16105497

4692. CHEMBL218006; (5s)-2-{[(1s)-1-(2-Fluorophenyl)ethyl]amino}-5-Methyl-5-(Trifluoromethyl)-1,3-Thiazol-4(5h)-One; SCHEMBL1690433 ...
MW:     320.305793 g/mol MF: C13H12F4N2OS
IUPAC name: (5S)-2-[[(1S)-1-(2-fluorophenyl)ethyl]amino]-5-methyl-5-(tri...
Create Date: 2007-06-18
CID: 16105493

4693. CHEMBL384684; SCHEMBL1690398; BDBM13753 ...
MW:     320.305793 g/mol MF: C13H12F4N2OS
IUPAC name: (5R)-2-[[(1S)-1-(2-fluorophenyl)ethyl]amino]-5-methyl-5-(tri...
Create Date: 2007-06-18
CID: 16105492

4694. CHEMBL221749; SCHEMBL1605428; BDBM13749 ...
MW:     294.387563 g/mol MF: C15H19FN2OS
IUPAC name: (5S)-2-[[(1S)-1-(2-fluorophenyl)ethyl]amino]-5-methyl-5-prop...
Create Date: 2007-06-18
CID: 16105490

4695. CHEMBL221084; SCHEMBL14429457; BDBM13748 ...
MW:     355.293160 g/mol MF: C15H19BrN2OS
IUPAC name: 2-[[(1S)-1-(2-bromophenyl)ethyl]amino]-5-methyl-5-propan-2-y...
Create Date: 2007-06-18
CID: 16105489

4696. CHEMBL219085; BDBM13048; 3-quinolinecarbonitrile analog 15 ...
MW:     552.451680 g/mol MF: C28H27Cl2N5O3
IUPAC name: 4-(2,4-dichloro-5-methoxyanilino)-6-methoxy-7-[5-[(4-methylp...
Create Date: 2007-06-18
CID: 16099179

4697. CHEMBL220348; BDBM13050; 3-quinolinecarbonitrile analog 20 ...
MW:     522.425700 g/mol MF: C27H25Cl2N5O2
IUPAC name: 4-(2,4-dichloro-5-methoxyanilino)-6-[5-[(4-methylpiperazin-1...
Create Date: 2007-06-18
CID: 16099174

4698. CHEMBL216599; BDBM13049; 3-quinolinecarbonitrile analog 17 ...
MW:     492.399720 g/mol MF: C26H23Cl2N5O
IUPAC name: 4-(2,4-dichloroanilino)-7-[5-[(4-methylpiperazin-1-yl)methyl...
Create Date: 2007-06-18
CID: 16099173

4699. CHEMBL283662; SCHEMBL7721328; BDBM22182 ...
MW:     464.546806 g/mol MF: C28H30F2N2O2
IUPAC name: 3-[4-[2-[bis(4-fluorophenyl)methoxy]ethyl]piperazin-1-yl]-1-...
Create Date: 2007-02-07
CID: 12017337

4700. CHEMBL244205; BDBM19967; LY2066948 analogue, 17 ...
MW:     457.535923 g/mol MF: C29H28FNO3
IUPAC name: 6-(4-fluorophenyl)-5-[4-(2-piperidin-1-ylethoxy)phenoxy]naph...
Create Date: 2006-10-26
CID: 11720175

4701. 5-Chloro-N-({(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl}methyl)pyridine-2-carboxamide; 5-chloro-N-{[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl}pyridine-2-carboxamide; CHEMBL197547 ...
MW:     430.841660 g/mol MF: C20H19ClN4O5
IUPAC name: 5-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,...
Create Date: 2006-10-26
CID: 11718954

4702. CHEMBL278495; SCHEMBL3993796; BDBM13053 ...
MW:     614.521060 g/mol MF: C33H29Cl2N5O3
IUPAC name: 4-(2,4-dichloro-5-methoxyanilino)-6-methoxy-7-[5-[(4-phenylp...
Create Date: 2006-10-26
CID: 11650224

4703. CHEMBL235954; SCHEMBL14340840; BDBM23524 ...
MW:     401.863340 g/mol MF: C20H16ClNO4S
IUPAC name: 2-[3-[5-(2-chloro-4-hydroxyphenyl)thiophen-2-yl]propanoylami...
Create Date: 2006-10-26
CID: 11647028

4704. 5-Chloro-N-({(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl}methyl)thiophene-2-sulfonamide; 5-chloro-N-{[(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl}thiophene-2-sulfonamide; CHEMBL194889 ...
MW:     471.935020 g/mol MF: C18H18ClN3O6S2
IUPAC name: 5-chloro-N-[[(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,...
Create Date: 2006-10-26
CID: 11619782

4705. 2-Chloro-N-({(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl}methyl)-1,3-thiazole-5-carboxamide; 2-chloro-N-{[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl}-1,3-thiazole-5-carboxamide; CHEMBL370176 ...
MW:     436.869380 g/mol MF: C18H17ClN4O5S
IUPAC name: 2-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,...
Create Date: 2006-10-26
CID: 11618984

4706. CHEMBL235952; SCHEMBL14340792; BDBM23522 ...
MW:     362.378620 g/mol MF: C21H18N2O4
IUPAC name: 2-[3-[4-(5-hydroxypyridin-2-yl)phenyl]propanoylamino]benzoic...
Create Date: 2006-10-26
CID: 11617480

4707. CHEMBL235741; SCHEMBL12671515; BDBM23519 ...
MW:     345.391160 g/mol MF: C22H19NO3
IUPAC name: 2-[3-(4-phenylphenyl)propanoylamino]benzoic acid
Create Date: 2006-10-26
CID: 11617151

4708. CHEMBL237247; SCHEMBL14340847; BDBM23531 ...
MW:     369.394400 g/mol MF: C18H15N3O4S
IUPAC name: 2-[3-[5-(5-hydroxypyridin-2-yl)-1,3-thiazol-2-yl]propanoylam...
Create Date: 2006-10-26
CID: 11610363

4709. CHEMBL235740; 2-(3-(naphthalen-2-yl)propanamido)benzoic acid; 2-[3-(naphthalen-2-yl)propanamido]benzoic acid ...
MW:     319.353880 g/mol MF: C20H17NO3
IUPAC name: 2-(3-naphthalen-2-ylpropanoylamino)benzoic acid
Create Date: 2006-10-26
CID: 11594881

4710. N-({(5S)-3-[3-Amino-4-(3-oxomorpholin-4-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl}methyl)-5-chlorothiophene-2-carboxamide; N-{[(5S)-3-[3-amino-4-(3-oxomorpholin-4-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl}-5-chlorothiophene-2-carboxamide; CHEMBL196539 ...
MW:     450.895960 g/mol MF: C19H19ClN4O5S
IUPAC name: N-[[(5S)-3-[3-amino-4-(3-oxomorpholin-4-yl)phenyl]-2-oxo-1,3...
Create Date: 2006-10-26
CID: 11583256

4711. CHEMBL391603; SCHEMBL14340846; BDBM23521 ...
MW:     346.379220 g/mol MF: C21H18N2O3
IUPAC name: 2-[3-(4-pyridin-2-ylphenyl)propanoylamino]benzoic acid
Create Date: 2006-10-26
CID: 11566404

4712. 5-Chloro-N-({(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)-3-(trifluoromethyl)phenyl]-1,3-oxazolidin-5-yl}methyl)thiophene-2-carboxamide; 5-chloro-N-{[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)-3-(trifluoromethyl)phenyl]-1,3-oxazolidin-5-yl]methyl}thiophene-2-carboxamide; CHEMBL194186 ...
MW:     503.879290 g/mol MF: C20H17ClF3N3O5S
IUPAC name: 5-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)-3-(triflu...
Create Date: 2006-10-26
CID: 11562451

4713. CHEMBL235256; SCHEMBL14340841; BDBM23520 ...
MW:     395.835620 g/mol MF: C22H18ClNO4
IUPAC name: 2-[3-[4-(2-chloro-4-hydroxyphenyl)phenyl]propanoylamino]benz...
Create Date: 2006-10-26
CID: 11560300

4714. 4-Amino-5-chloro-N-({(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl}methyl)thiophene-2-carboxamide; 4-amino-5-chloro-N-{[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl}thiophene-2-carboxamide; CHEMBL371336 ...
MW:     450.895960 g/mol MF: C19H19ClN4O5S
IUPAC name: 4-amino-5-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)ph...
Create Date: 2006-10-26
CID: 11554212

4715. 2-Chloro-N-({(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl}methyl)benzamide; 2-chloro-N-{[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl}benzamide; CHEMBL196669 ...
MW:     429.853600 g/mol MF: C21H20ClN3O5
IUPAC name: 2-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,...
Create Date: 2006-10-26
CID: 11546456

4716. CHEMBL276934; SCHEMBL3995550; BDBM13051 ...
MW:     539.409860 g/mol MF: C27H24Cl2N4O4
IUPAC name: 4-(2,4-dichloro-5-methoxyanilino)-6-methoxy-7-[5-(morpholin-...
Create Date: 2006-10-26
CID: 11541124

4717. CHEMBL219964; SCHEMBL3990270; BDBM13052 ...
MW:     497.373180 g/mol MF: C25H22Cl2N4O3
IUPAC name: 4-(2,4-dichloro-5-methoxyanilino)-7-[5-[(dimethylamino)methy...
Create Date: 2006-10-26
CID: 11540547

4718. CHEMBL436293; SCHEMBL13703513; BDBM13011 ...
MW:     430.841660 g/mol MF: C20H19ClN4O5
IUPAC name: 6-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,...
Create Date: 2006-10-26
CID: 11539245

4719. SCHEMBL87622; CHEMBL364284; BDBM12997 ...
MW:     453.871783 g/mol MF: C19H17ClFN3O5S
IUPAC name: 5-chloro-N-[[(5S)-3-[3-fluoro-4-(3-oxomorpholin-4-yl)phenyl]...
Create Date: 2006-10-26
CID: 11525292

4720. 5-R-Rivaroxaban; 865479-71-6; 5-Chloro-N-({(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl}methyl)thiophene-2-carboxamide ...
MW:     435.881320 g/mol MF: C19H18ClN3O5S
IUPAC name: 5-chloro-N-[[(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,...
Create Date: 2006-10-26
CID: 11524901

4721. 5-Chloro-N-methyl-N-({(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl}methyl)thiophene-2-carboxamide; 5-chloro-N-methyl-N-{[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl}thiophene-2-carboxamide; CHEMBL198421 ...
MW:     449.907900 g/mol MF: C20H20ClN3O5S
IUPAC name: 5-chloro-N-methyl-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)p...
Create Date: 2006-10-26
CID: 11518043

4722. 3-Chloro-N-({(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl}methyl)benzamide; 3-chloro-N-{[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl}benzamide; CHEMBL372568 ...
MW:     429.853600 g/mol MF: C21H20ClN3O5
IUPAC name: 3-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,...
Create Date: 2006-10-26
CID: 11517577

4723. SKI-758; CHEMBL219557; SCHEMBL3992463 ...
MW:     552.451680 g/mol MF: C28H27Cl2N5O3
IUPAC name: 4-(2,4-dichloro-5-methoxyanilino)-6-methoxy-7-[5-[(4-methylp...
Create Date: 2006-10-26
CID: 11341869

4724. CHEMBL564530; SCHEMBL4693282; BDBM29796 ...
MW:     566.635530 g/mol MF: C27H33F3N4O4S
Create Date: 2006-10-26
CID: 11192316

4725. TCMDC-135785; CHEMBL559355; SCHEMBL4693081 ...
MW:     554.700820 g/mol MF: C29H38N4O5S
Create Date: 2006-10-26
CID: 11157167

4726. CHEMBL186337; SCHEMBL5619865; SCHEMBL5619870 ...
MW:     410.376820 g/mol MF: C21H18N2O7
IUPAC name: 4-amino-5-[3-[(E)-3-(3-hydroxy-2-methoxycarbonylphenoxy)prop...
Create Date: 2006-10-25
CID: 10364207

4727. CHEMBL363687; SCHEMBL5621461; BDBM13993 ...
MW:     398.366120 g/mol MF: C20H18N2O7
IUPAC name: 5-[3-[2-(3-hydroxy-2-methoxycarbonylphenoxy)ethylamino]pheny...
Create Date: 2006-10-25
CID: 10250245

4728. CHEMBL206514; BDBM14907; 5-amidino benzimidazole analog 18 ...
MW:     474.465380 g/mol MF: C25H22N4O6
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2006-10-25
CID: 10183922

4729. CHEMBL381866; SCHEMBL3599247; BDBM13004 ...
MW:     464.266720 g/mol MF: C19H18BrN3O6
IUPAC name: 5-bromo-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3...
Create Date: 2006-10-25
CID: 10161902

4730. SCHEMBL17346795; BDBM13994; Isoxazole carboxylic acid analog 5 ...
MW:     409.388760 g/mol MF: C22H19NO7
IUPAC name: 5-[3-[2-[(3-hydroxy-2-methoxycarbonylphenoxy)methyl]cyclopro...
Create Date: 2006-10-25
CID: 10092909

4731. 17.beta.-Hydroxy Wortmannin; SCHEMBL13483279; BDBM21034 ...
MW:     430.447740 g/mol MF: C23H26O8
Create Date: 2006-10-25
CID: 10002774

4732. Benzenamine, 3-(1H-1,2,3-triazol-5-yl)-; 369363-60-0; CHEMBL198194 ...
MW:     160.175920 g/mol MF: C8H8N4
IUPAC name: 3-(2H-triazol-4-yl)aniline
Create Date: 2006-10-25
CID: 9964175

4733. CHEMBL382776; SCHEMBL6395319; BDBM14908 ...
MW:     489.436960 g/mol MF: C24H19N5O7
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2006-10-25
CID: 9957171

4734. CHEMBL382292; SCHEMBL5020211; 1,2,3-triazole analogue, 21 ...
MW:     250.298460 g/mol MF: C15H14N4
IUPAC name: N-benzyl-3-(2H-triazol-4-yl)aniline
Create Date: 2006-10-25
CID: 9942963

4735. CHEMBL196492; SCHEMBL7091435; BDBM13005 ...
MW:     429.853600 g/mol MF: C21H20ClN3O5
IUPAC name: 4-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,...
Create Date: 2006-10-25
CID: 9932394

4736. 1H-1,2,3-Triazole, 4-(4-ethylphenyl)-; 56527-22-1; CHEMBL194423 ...
MW:     173.214440 g/mol MF: C10H11N3
IUPAC name: 4-(4-ethylphenyl)-2H-triazole
Create Date: 2006-10-25
CID: 9920495

4737. Phenol, 4-(1H-1,2,3-triazol-4-yl)-; 89221-21-6; ACMC-20ljb5 ...
MW:     161.160680 g/mol MF: C8H7N3O
IUPAC name: 4-(1,2-dihydrotriazol-5-ylidene)cyclohexa-2,5-dien-1-one
Create Date: 2006-10-25
CID: 9920457

4738. CHEMBL426307; SCHEMBL6390715; BDBM14924 ...
MW:     510.446306 g/mol MF: C25H20F2N4O6
IUPAC name: 2-[(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene...
Create Date: 2006-10-25
CID: 9914298

4739. CHEMBL231037; SCHEMBL8297242; BDBM25926 ...
MW:     291.350380 g/mol MF: C17H17N5
Create Date: 2006-10-25
CID: 9900652

4740. 4-triazolylaniline; Benzenamine, 4-(1H-1,2,3-triazol-4-yl)-; 89221-20-5 ...
MW:     160.175920 g/mol MF: C8H8N4
IUPAC name: 4-(2H-triazol-4-yl)aniline
Create Date: 2006-10-25
CID: 9898901

4741. Oxybutynin related compound C; N-Desethyl-N-methyl oxybutynin; SCHEMBL7529916 ...
MW:     343.459860 g/mol MF: C21H29NO3
IUPAC name: 4-[ethyl(methyl)amino]but-2-ynyl 2-cyclohexyl-2-hydroxy-2-ph...
Create Date: 2006-10-25
CID: 9884509

4742. 3-(1H-1,2,3-triazol-4-yl)pyridine; 120241-79-4; 3-(1,2,3-triazol-4-yl)pyridine ...
MW:     146.149340 g/mol MF: C7H6N4
IUPAC name: 3-(2H-triazol-4-yl)pyridine
Create Date: 2006-10-25
CID: 9833992

4743. 3-(1H-1,2,3-triazol-4-yl)phenol; 369363-54-2; CHEMBL198937 ...
MW:     161.160680 g/mol MF: C8H7N3O
IUPAC name: 3-(2H-triazol-4-yl)phenol
Create Date: 2006-10-25
CID: 9815283

4744. CHEMBL364051; SCHEMBL5020208; 4-(triazol-4-yl)phenyl iodide ...
MW:     271.057810 g/mol MF: C8H6IN3
IUPAC name: 4-(4-iodophenyl)-2H-triazole
Create Date: 2006-10-25
CID: 9814061

4745. CHEMBL231036; SCHEMBL5083193; BDBM25925 ...
MW:     262.309160 g/mol MF: C16H14N4
Create Date: 2006-10-25
CID: 9813880

4746. 2-(1h-[1,2,3]triazol-4-yl)pyridine; 2-(1H-(1,2,3)Triazol-4-yl)-pyridine; pyridyl-triazole ...
MW:     146.149340 g/mol MF: C7H6N4
IUPAC name: 2-(2H-triazol-4-yl)pyridine
Create Date: 2006-10-25
CID: 9812807

4747. 4-(4-bromophenyl)-1H-1,2,3-triazole; 5-(4-bromophenyl)-1H-1,2,3-triazole; 5301-98-4 ...
MW:     224.057340 g/mol MF: C8H6BrN3
IUPAC name: 4-(4-bromophenyl)-2H-triazole
Create Date: 2006-01-25
CID: 6419341

4748. 4-(3-bromophenyl)-1H-1,2,3-triazole; 5-(3-bromophenyl)-1H-1,2,3-Triazole; ST51035989 ...
MW:     224.057340 g/mol MF: C8H6BrN3
IUPAC name: 4-(3-bromophenyl)-2H-triazole
Create Date: 2006-01-25
CID: 6400901

4749. AC1O3ED9; BDBM1266; L-682, 679 analog 25
MW:     672.853380 g/mol MF: C39H52N4O6
IUPAC name: tert-butyl N-[(2S,3S,5R)-6-[[(2S)-1-[[(2S)-1-amino-1-oxo-3-p...
Create Date: 2006-01-30
CID: 6326398

4750. AC1O3ED6; CHEMBL97544; BDBM1265 ...
MW:     525.679520 g/mol MF: C30H43N3O5
IUPAC name: tert-butyl N-[(2S,3S,5R)-6-[[(2R)-1-amino-4-methyl-1-oxopent...
Create Date: 2006-01-30
CID: 6326397

4751. (3-phenoxyprop-1-en-1-yl)benzene; STK671370; cinnamyloxybenzene ...
MW:     210.271060 g/mol MF: C15H14O
IUPAC name: [(E)-3-phenoxyprop-1-enyl]benzene
Create Date: 2005-09-08
CID: 5814240

4752. AC1NUI1H; CHEMBL58522; BDBM1280 ...
MW:     596.800480 g/mol MF: C34H52N4O5
IUPAC name: tert-butyl N-[(2S,3S,5R)-5-benzyl-6-[[(2S)-1-[3-(dimethylami...
Create Date: 2005-08-01
CID: 5479289

4753. AC1NUI1E; BDBM1279; CHEMBL318700 ...
MW:     610.827060 g/mol MF: C35H54N4O5
IUPAC name: tert-butyl N-[(2S,3S,5R)-5-benzyl-6-[[(2S)-1-[3-(dimethylami...
Create Date: 2005-08-01
CID: 5479288

4754. AC1NUI1B; BDBM1278; CHEMBL263236 ...
MW:     610.827060 g/mol MF: C35H54N4O5
IUPAC name: tert-butyl N-[(2S,3S,5R)-5-benzyl-6-[[(2S)-1-[3-(dimethylami...
Create Date: 2005-08-01
CID: 5479287

4755. AC1NUI18; BDBM1277; CHEMBL100310 ...
MW:     585.731480 g/mol MF: C32H47N3O7
IUPAC name: tert-butyl N-[(2S,3S,5R)-5-benzyl-6-[[(2S)-1-(2,3-dihydroxyp...
Create Date: 2005-08-01
CID: 5479286

4756. AC1NUI15; BDBM1276; CHEMBL431999 ...
MW:     599.758060 g/mol MF: C33H49N3O7
IUPAC name: tert-butyl N-[(2S,3S,5R)-5-benzyl-6-[[(2S)-1-(2,3-dihydroxyp...
Create Date: 2005-08-01
CID: 5479285

4757. AC1NUI12; CHEMBL95413; BDBM1275 ...
MW:     555.705500 g/mol MF: C31H45N3O6
IUPAC name: tert-butyl N-[(2S,3S,5R)-5-benzyl-3-hydroxy-6-[[(2S)-1-(2-hy...
Create Date: 2005-08-01
CID: 5479284

4758. AC1NUI0Z; CHEMBL98129; BDBM1274 ...
MW:     569.732080 g/mol MF: C32H47N3O6
IUPAC name: tert-butyl N-[(2S,3S,5R)-5-benzyl-3-hydroxy-6-[[(2S)-1-(2-hy...
Create Date: 2005-08-01
CID: 5479283

4759. AC1NUI0W; CHEMBL98284; BDBM1273 ...
MW:     569.732080 g/mol MF: C32H47N3O6
IUPAC name: tert-butyl N-[(2S,3S,5R)-5-benzyl-3-hydroxy-6-[[(2S)-1-(2-hy...
Create Date: 2005-08-01
CID: 5479282

4760. AC1NUI0Q; BDBM1269; CHEMBL329750 ...
MW:     601.775480 g/mol MF: C36H47N3O5
IUPAC name: tert-butyl N-[(2S,3S,5R)-5-benzyl-6-[[(2S)-1-(benzylamino)-3...
Create Date: 2005-08-01
CID: 5479280

4761. AC1NUI0N; BDBM1268; CHEMBL430868 ...
MW:     615.802060 g/mol MF: C37H49N3O5
IUPAC name: tert-butyl N-[(2S,3S,5R)-5-benzyl-6-[[(2S)-1-(benzylamino)-3...
Create Date: 2005-08-01
CID: 5479279

4762. AC1NUI0K; CHEMBL94316; BDBM1264 ...
MW:     549.661160 g/mol MF: C30H39N5O5
IUPAC name: tert-butyl N-[(2S,3S,5R)-6-[[(2S)-1-amino-3-(1H-imidazol-2-y...
Create Date: 2005-08-01
CID: 5479278

4763. AC1NUI0H; CHEMBL95316; BDBM1262 ...
MW:     499.599180 g/mol MF: C27H37N3O6
IUPAC name: tert-butyl N-[(2S,3S,5R)-6-[[(2S)-1-amino-3-hydroxy-1-oxopro...
Create Date: 2005-08-01
CID: 5479277

4764. AC1NUI0E; CHEMBL95467; BDBM1261 ...
MW:     565.743380 g/mol MF: C33H47N3O5
IUPAC name: tert-butyl N-[(2S,3S,5R)-6-[[(2S)-1-amino-3-cyclohexyl-1-oxo...
Create Date: 2005-08-01
CID: 5479276

4765. AC1NUI0B; CHEMBL97423; BDBM1260 ...
MW:     559.695740 g/mol MF: C33H41N3O5
IUPAC name: tert-butyl N-[(2S,3S,5R)-6-[[(2S)-1-amino-1-oxo-3-phenylprop...
Create Date: 2005-08-01
CID: 5479275

4766. AC1NUI08; CHEMBL99016; BDBM1259 ...
MW:     551.716800 g/mol MF: C32H45N3O5
IUPAC name: tert-butyl N-[(2S,3S,5R)-6-[[(1S)-2-amino-1-cyclohexyl-2-oxo...
Create Date: 2005-08-01
CID: 5479274

4767. AC1NUI05; CHEMBL98355; BDBM1258 ...
MW:     545.669160 g/mol MF: C32H39N3O5
IUPAC name: tert-butyl N-[(2S,3S,5R)-6-[[(1S)-2-amino-2-oxo-1-phenylethy...
Create Date: 2005-08-01
CID: 5479273

4768. AC1NUI02; CHEMBL97847; BDBM1257 ...
MW:     525.679520 g/mol MF: C30H43N3O5
IUPAC name: tert-butyl N-[(2S,3S,5R)-6-[[(2S)-1-amino-3-methyl-1-oxopent...
Create Date: 2005-08-01
CID: 5479272

4769. AC1NUHZZ; CHEMBL94266; BDBM1255 ...
MW:     483.599780 g/mol MF: C27H37N3O5
IUPAC name: tert-butyl N-[(2S,3S,5R)-6-[[(2S)-1-amino-1-oxopropan-2-yl]a...
Create Date: 2005-08-01
CID: 5479271

4770. AC1NUHZW; BDBM1254; CHEMBL319126 ...
MW:     469.573200 g/mol MF: C26H35N3O5
IUPAC name: tert-butyl N-[(2S,3S,5R)-6-[(2-amino-2-oxoethyl)amino]-5-ben...
Create Date: 2005-08-01
CID: 5479270

4771. Boc-CH2Ph-Leu-NH2; 126409-30-1; AC1NUHYW ...
MW:     525.679520 g/mol MF: C30H43N3O5
IUPAC name: tert-butyl N-[(2S,3S,5R)-6-[[(2S)-1-amino-4-methyl-1-oxopent...
Create Date: 2005-08-01
CID: 5479254

4772. 98818-68-9; Carbamic acid, (2-hydroxy-5-((3-methyl-1-(((phenylmethyl)amino)carbonyl)butyl)amino)-5-oxo-1,4-bis(phenylmethyl)pentyl)-, 1,1-dimethylethyl ester, (1S-(1R*,2R*,4S*,5(R*)))-; AC1NUHYT ...
MW:     615.802060 g/mol MF: C37H49N3O5
IUPAC name: tert-butyl N-[(2S,3S,5R)-5-benzyl-6-[[(2S)-1-(benzylamino)-4...
Create Date: 2005-08-01
CID: 5479253

4773. 132565-31-2; Carbamic acid, (2-hydroxy-5-((3-methyl-1-(((2-phenylethyl)amino)carbonyl)butyl)amino)-5-oxo-1,4-bis(phenylmethyl)pentyl)-, 1,1-dimethylethyl ester, (1S-(1R*,2R*,4S*(R*)))-; AC1NUHYQ ...
MW:     629.828640 g/mol MF: C38H51N3O5
IUPAC name: tert-butyl N-[(2S,3S,5R)-5-benzyl-3-hydroxy-6-[[(2S)-4-methy...
Create Date: 2005-08-01
CID: 5479252

4774. AC1NS96B; 4-Anilino-7-phenyl-3-quinolinecarbonitrile 15m; BDBM6493 ...
MW:     532.463580 g/mol MF: C29H27Cl2N5O
IUPAC name: 4-(2,4-dichloro-5-methoxyanilino)-7-[4-[(4-methylpiperazin-1...
Create Date: 2006-01-30
CID: 5330459

4775. 7-thienyl-3-quinolinecarbonitrile 16; AC1NS8CH; BDBM6114 ...
MW:     538.491300 g/mol MF: C27H25Cl2N5OS
IUPAC name: 4-(2,4-dichloro-5-methoxyanilino)-7-[5-[(4-methylpiperazin-1...
Create Date: 2006-01-30
CID: 5330101

4776. 7-thienyl-3-quinolinecarbonitrile 14; AC1NS8CB; BDBM6112 ...
MW:     538.491300 g/mol MF: C27H25Cl2N5OS
IUPAC name: 4-(2,4-dichloro-5-methoxyanilino)-7-[5-[(4-methylpiperazin-1...
Create Date: 2006-01-30
CID: 5330099

4777. AC1NS32E; BDBM2919; SCHEMBL1152977 ...
MW:     343.315993 g/mol MF: C17H17F4NO2
IUPAC name: (3S,5S)-5-[(E)-2-cyclopropylethenyl]-3-ethyl-7-fluoro-5-(tri...
Create Date: 2006-01-30
CID: 5327780

4778. AC1NS32B; BDBM2918; SCHEMBL1152406 ...
MW:     329.289413 g/mol MF: C16H15F4NO2
IUPAC name: (3S,5S)-5-[(E)-2-cyclopropylethenyl]-7-fluoro-3-methyl-5-(tr...
Create Date: 2006-01-30
CID: 5327779

4779. AC1NS328; BDBM2913; SCHEMBL1151890 ...
MW:     359.770590 g/mol MF: C17H17ClF3NO2
IUPAC name: (3S,5S)-7-chloro-5-[(E)-2-cyclopropylethenyl]-3-ethyl-5-(tri...
Create Date: 2006-01-30
CID: 5327778

4780. AC1NS325; BDBM2912; SCHEMBL1152721 ...
MW:     345.744010 g/mol MF: C16H15ClF3NO2
IUPAC name: (3S,5S)-7-chloro-5-[(E)-2-cyclopropylethenyl]-3-methyl-5-(tr...
Create Date: 2006-01-30
CID: 5327777

4781. AC1NS31Z; CHEMBL32290; BDBM2904 ...
MW:     329.701550 g/mol MF: C15H11ClF3NO2
IUPAC name: 7-chloro-5-(2-cyclopropylethynyl)-5-(trifluoromethyl)-1H-4,1...
Create Date: 2006-01-30
CID: 5327775

4782. AC1NS31W; CHEMBL31455; BDBM2903 ...
MW:     355.695770 g/mol MF: C16H9ClF3NO3
IUPAC name: 7-chloro-5-[2-(furan-3-yl)ethynyl]-5-(trifluoromethyl)-1H-4,...
Create Date: 2006-01-30
CID: 5327774

4783. AC1NS31T; BDBM2902; CHEMBL283614 ...
MW:     331.717430 g/mol MF: C15H13ClF3NO2
IUPAC name: 7-chloro-5-(3-methylbut-1-ynyl)-5-(trifluoromethyl)-1H-4,1-b...
Create Date: 2006-01-30
CID: 5327773

4784. AC1NS31Q; BDBM2901; CHEMBL281239 ...
MW:     317.690850 g/mol MF: C14H11ClF3NO2
IUPAC name: 5-but-1-ynyl-7-chloro-5-(trifluoromethyl)-1H-4,1-benzoxazepi...
Create Date: 2006-01-30
CID: 5327772

4785. AC1NS31N; CHEMBL32460; BDBM2900 ...
MW:     365.733650 g/mol MF: C18H11ClF3NO2
IUPAC name: 7-chloro-5-(2-phenylethynyl)-5-(trifluoromethyl)-1H-4,1-benz...
Create Date: 2006-01-30
CID: 5327771

4786. (4S,5S)-2,7-dibenzyl-1,1-dioxo-1,2,7-thiadiazepane-4,5-diol; AC1MHYMU; BDBM4422 ...
MW:     362.443280 g/mol MF: C18H22N2O4S
IUPAC name: (4S,5S)-2,7-dibenzyl-1,1-dioxo-1,2,7-thiadiazepane-4,5-diol
Create Date: 2005-08-01
CID: 3013773

4787. NSC20866; NSC-20866; 109477-54-5 ...
MW:     508.872560 g/mol MF: C14H24N2O2S8
IUPAC name: O-butyl [2-[(butoxycarbothioyldisulfanyl)carbothioylamino]et...
Create Date: 2005-03-26
CID: 3001054

4788. F1604-0778; N-(3-methylphenyl)-3-[(2,4,6-trimethylphenyl)sulfonyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine; ZINC02691788 ...
MW:     457.547420 g/mol MF: C25H23N5O2S
IUPAC name: N-(3-methylphenyl)-3-(2,4,6-trimethylphenyl)sulfonyltriazolo...
Create Date: 2005-07-14
CID: 2137148

4789. CHEMBL228244; STK072229; 2-[2-(4-methoxyphenoxy)acetamido]benzoic acid ...
MW:     301.294000 g/mol MF: C16H15NO5
IUPAC name: 2-[[2-(4-methoxyphenoxy)acetyl]amino]benzoic acid
Create Date: 2005-07-09
CID: 882926

4790. 1-bromo-4-(phenoxymethyl)benzene; 20600-22-0; ST027783 ...
MW:     263.129840 g/mol MF: C13H11BrO
IUPAC name: 1-bromo-4-(phenoxymethyl)benzene
Create Date: 2005-07-08
CID: 726149

4791. AC1LDHKS; Fentanyl para-tolyl acetyl analog; JNQPTABAZAHVEN-UHFFFAOYSA-N ...
MW:     336.470520 g/mol MF: C22H28N2O
IUPAC name: N-(4-methylphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]acetam...
Create Date: 2005-03-27
CID: 618634

4792. s-{[(4-chlorophenyl)sulfinyl]methyl} o,o-diethyl phosphorothioate; Carbophenoxon sulfoxide; AC1LCAPY ...
MW:     342.799102 g/mol MF: C11H16ClO4PS2
IUPAC name: 1-chloro-4-(diethoxyphosphorylsulfanylmethylsulfinyl)benzene
Create Date: 2005-03-27
CID: 572999

4793. (3S,5S)-5-(2-cyclopropylethynyl)-3-ethyl-7-fluoro-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one; AC1LAER5; BDBM2917 ...
MW:     341.300113 g/mol MF: C17H15F4NO2
IUPAC name: (3S,5S)-5-(2-cyclopropylethynyl)-3-ethyl-7-fluoro-5-(trifluo...
Create Date: 2005-08-01
CID: 486700

4794. (3S,5S)-5-(2-cyclopropylethynyl)-7-fluoro-3-methyl-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one; AC1LAER2; BDBM2916 ...
MW:     327.273533 g/mol MF: C16H13F4NO2
IUPAC name: (3S,5S)-5-(2-cyclopropylethynyl)-7-fluoro-3-methyl-5-(triflu...
Create Date: 2005-08-01
CID: 486699

4795. (3S,5S)-7-chloro-5-(2-cyclopropylethynyl)-3-(2,2,2-trifluoroethyl)-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one; AC1LAEQT; BDBM2911 ...
MW:     411.726099 g/mol MF: C17H12ClF6NO2
IUPAC name: (3S,5S)-7-chloro-5-(2-cyclopropylethynyl)-3-(2,2,2-trifluoro...
Create Date: 2005-08-01
CID: 486696

4796. AC1LAEQQ; BDBM2910; SCHEMBL1153878 ...
MW:     371.781290 g/mol MF: C18H17ClF3NO2
IUPAC name: (3S,5S)-7-chloro-5-(2-cyclopropylethynyl)-3-propan-2-yl-5-(t...
Create Date: 2005-08-01
CID: 486695

4797. (3S,5S)-7-chloro-5-(2-cyclopropylethynyl)-3-propyl-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one; AC1LAEQN; BDBM2909 ...
MW:     371.781290 g/mol MF: C18H17ClF3NO2
IUPAC name: (3S,5S)-7-chloro-5-(2-cyclopropylethynyl)-3-propyl-5-(triflu...
Create Date: 2005-08-01
CID: 486694

4798. (3S,5S)-7-chloro-5-(2-cyclopropylethynyl)-3-ethyl-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one; AC1LAEQK; BDBM2908 ...
MW:     357.754710 g/mol MF: C17H15ClF3NO2
IUPAC name: (3S,5S)-7-chloro-5-(2-cyclopropylethynyl)-3-ethyl-5-(trifluo...
Create Date: 2005-08-01
CID: 486693

4799. (3R,5S)-7-chloro-5-(2-cyclopropylethynyl)-3-methyl-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one; AC1LAEQH; BDBM2907 ...
MW:     343.728130 g/mol MF: C16H13ClF3NO2
IUPAC name: (3R,5S)-7-chloro-5-(2-cyclopropylethynyl)-3-methyl-5-(triflu...
Create Date: 2005-08-01
CID: 486692

4800. 247091-19-6; AC1LAB7N; SCHEMBL5934336 ...
MW:     247.253220 g/mol MF: C11H13N5O2
IUPAC name: [2-[(2-amino-6-methoxypurin-9-yl)methylidene]cyclopropyl]met...
Create Date: 2005-08-01
CID: 484899

4801. N-(2-methylsulfonylphenyl)-2-[[2-[(2-methylsulfonylphenyl)carbamoyl]phenyl]disulfanyl]benzamide; AC1LAI4E; 2, 2'-Dithiobisbenzamide analog ...
MW:     612.759960 g/mol MF: C28H24N2O6S4
IUPAC name: N-(2-methylsulfonylphenyl)-2-[[2-[(2-methylsulfonylphenyl)ca...
Create Date: 2005-08-01
CID: 468892

4802. AC1LA3R6; Pyrrolothiazol-6,7-diCOOH analog; MCULE-3518202065 ...
MW:     361.412160 g/mol MF: C18H19NO5S
IUPAC name: dimethyl 3-(4-methoxyphenyl)-5-methyl-1,3-dihydropyrrolo[1,2...
Create Date: 2005-08-01
CID: 461167

4803. AC1L9SCO; CHEMBL84900; BDBM1382 ...
MW:     295.398680 g/mol MF: C18H17NOS
IUPAC name: 9b-(3,5-dimethylphenyl)-2,3-dihydro-[1,3]thiazolo[2,3-a]isoi...
Create Date: 2005-08-01
CID: 455187

4804. AC1L9R16; BDBM1281; CHEMBL329974 ...
MW:     630.816700 g/mol MF: C37H50N4O5
IUPAC name: tert-butyl N-[(2S,3S,5R)-5-benzyl-6-[[(1S)-2-[3-(dimethylami...
Create Date: 2005-08-01
CID: 453532

4805. AC1L9R15; BDBM1270; CHEMBL319013 ...
MW:     635.791700 g/mol MF: C39H45N3O5
IUPAC name: tert-butyl N-[(2S,3S,5R)-5-benzyl-6-[[(1S)-2-(benzylamino)-2...
Create Date: 2005-08-01
CID: 453522

4806. AC1L9R13; BDBM1263; CHEMBL262764 ...
MW:     598.731780 g/mol MF: C35H42N4O5
IUPAC name: tert-butyl N-[(2S,3S,5R)-6-[[(2S)-1-amino-3-(1H-indol-2-yl)-...
Create Date: 2005-08-01
CID: 453517

4807. SAA-I-VV-OMe; AC1L9PRP; Statine analog (SAA-I-VV-OMe) ...
MW:     664.790080 g/mol MF: C32H52N6O9
IUPAC name: methyl (2S)-2-[[(2S)-2-[[(3S,4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-...
Create Date: 2005-08-01
CID: 451628

4808. 5-(3-{3-[3-HYDROXY-2-(METHOXYCARBONYL)PHENOXY]PROPENYL}PHENYL)-4-(HYDROXYMETHYL)ISOXAZOLE-3-CARBOXYLIC ACID; IX1; 5-{3-[(1E)-3-[3-hydroxy-2-(methoxycarbonyl)phenoxy]prop-1-en-1-yl]phenyl}-4-(hydroxymethyl)-1,2-oxazole-3-carboxylic acid ...
MW:     425.388160 g/mol MF: C22H19NO8
IUPAC name: 5-[3-[(E)-3-(3-hydroxy-2-methoxycarbonylphenoxy)prop-1-enyl]...
Create Date: 2005-06-24
CID: 449162

4809. COMPOUND 9; CHEMBL117869; 5-{2-FLUORO-5-[3-(3-HYDROXY-2-METHOXYCARBONYL-PHENOXY)-PROPENYL]-PHENYL}-ISOXAZOLE-3-CARBOXYLIC ACID ...
MW:     413.352643 g/mol MF: C21H16FNO7
IUPAC name: 5-[2-fluoro-5-[(E)-3-(3-hydroxy-2-methoxycarbonylphenoxy)pro...
Create Date: 2005-06-24
CID: 447994

4810. Benzyl phenyl ether; (benzyloxy)benzene; 946-80-5 ...
MW:     184.233780 g/mol MF: C13H12O
IUPAC name: phenoxymethylbenzene
Create Date: 2005-03-26
CID: 70352

4811. PD 169316; 152121-53-4; 4-(4-(4-fluorophenyl)-2-(4-nitrophenyl)-1H-imidazol-5-yl)pyridine ...
MW:     360.341223 g/mol MF: C20H13FN4O2
IUPAC name: 4-[4-(4-fluorophenyl)-2-(4-nitrophenyl)-1H-imidazol-5-yl]pyr...
Create Date: 2005-03-25
CID: 4712

4812. Ketoace; CHEMBL435360; AC1L4FVC ...
MW:     422.473640 g/mol MF: C24H26N2O5
IUPAC name: (2S)-1-[(5S)-5-benzamido-4-oxo-6-phenylhexanoyl]pyrrolidine-...
Create Date: 2005-08-08
CID: 156271

4813. multisubstrate analogue inhibitor 15; BDBM50017763; CID44374941 ...
MW:     760.601982 g/mol MF: C30H33N8O14P-4
IUPAC name: 2-[[4-[[2-amino-5-[[1-[(4R,5R)-4-hydroxy-5-(phosphonatooxyme...
Create Date: 2015-10-08
CID: 91928945

4814. BDBM30468; benzothiazine-containing analog, 4c
MW:     506.595040 g/mol MF: C22H26N4O6S2
IUPAC name: N-methyl-N-[(3Z)-3-[1-(3-methylbutyl)-2,4-dioxopyrrolo[1,2-b...
Create Date: 2015-10-06
CID: 91896101

4815. BDBM30467; benzothiazine-containing analog, 4b
MW:     492.568460 g/mol MF: C21H24N4O6S2
IUPAC name: N-[(3Z)-3-[1-(3-methylbutyl)-2,4-dioxopyrrolo[1,2-b]pyridazi...
Create Date: 2015-10-06
CID: 91896100

4816. BDBM30466; benzothiazine-containing analog, 4a
MW:     506.595040 g/mol MF: C22H26N4O6S2
IUPAC name: N-[(3Z)-3-[1-(3,3-dimethylbutyl)-2,4-dioxopyrrolo[1,2-b]pyri...
Create Date: 2015-10-06
CID: 91896099

4817. BDBM30465; benzothiazine-containing analog, 3i
MW:     584.686960 g/mol MF: C26H24N4O6S3
IUPAC name: N-[(3Z)-3-[2-benzyl-6-(5-methylthiophen-2-yl)-3,5-dioxopyrid...
Create Date: 2015-10-06
CID: 91896098

4818. BDBM30464; benzothiazine-containing analog, 3h
MW:     550.670740 g/mol MF: C23H26N4O6S3
IUPAC name: N-methyl-N-[(3Z)-3-[2-(3-methylbutyl)-3,5-dioxo-6-thiophen-2...
Create Date: 2015-10-06
CID: 91896097

4819. BDBM30463; benzothiazine-containing analog, 3g
MW:     570.660380 g/mol MF: C25H22N4O6S3
IUPAC name: N-[(3Z)-3-[2-benzyl-6-(5-methylthiophen-2-yl)-3,5-dioxopyrid...
Create Date: 2015-10-06
CID: 91896096

4820. BDBM30462; benzothiazine-containing analog, 3f
MW:     530.616440 g/mol MF: C24H26N4O6S2
IUPAC name: N-[(3Z)-3-[2-(3-methylbutyl)-3,5-dioxo-6-phenylpyridazin-4-y...
Create Date: 2015-10-06
CID: 91896095

4821. BDBM30461; benzothiazine-containing analog, 3e
MW:     556.633800 g/mol MF: C24H20N4O6S3
IUPAC name: N-[(3Z)-3-(2-benzyl-3,5-dioxo-6-thiophen-2-ylpyridazin-4-yli...
Create Date: 2015-10-06
CID: 91896094

4822. BDBM30460; benzothiazine-containing analog, 3d
MW:     520.601700 g/mol MF: C21H20N4O6S3
IUPAC name: N-[(3Z)-3-[2-(cyclopropylmethyl)-3,5-dioxo-6-thiophen-2-ylpy...
Create Date: 2015-10-06
CID: 91896093

4823. BDBM30459; benzothiazine-containing analog, 3c
MW:     548.654860 g/mol MF: C23H24N4O6S3
IUPAC name: N-[(3Z)-3-[2-(cyclopentylmethyl)-3,5-dioxo-6-thiophen-2-ylpy...
Create Date: 2015-10-06
CID: 91896092

4824. BDBM30458; benzothiazine-containing analog, 3b
MW:     564.697320 g/mol MF: C24H28N4O6S3
IUPAC name: N-[(3Z)-3-[2-(3,3-dimethylpentyl)-3,5-dioxo-6-thiophen-2-ylp...
Create Date: 2015-10-06
CID: 91896091

4825. BDBM21040; 17-Hydroxywortmannin Analogue, 17; (2R,3S,6Z,14S,15S,17R)-6-({benzyl[2-(dimethylamino)ethyl]amino}methylidene)-8,14-dihydroxy-3-(methoxymethyl)-2,15-dimethyl-5,9-dioxo-4-oxatetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-1(10),7-dien-17-yl acetate
MW:     608.721760 g/mol MF: C34H44N2O8
IUPAC name: [(1S,6Z,9S,9aS,10R,11aS)-6-[[benzyl-[2-(dimethylamino)ethyl]...
Create Date: 2015-10-06
CID: 91895948

4826. BDBM21039; 17-Hydroxywortmannin Analogue, 16; (2R,3S,6Z,14S,15S,17R)-6-({tert-butyl[2-(dimethylamino)ethyl]amino}methylidene)-8,14-dihydroxy-3-(methoxymethyl)-2,15-dimethyl-5,9-dioxo-4-oxatetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-1(10),7-dien-17-yl acetate
MW:     574.705540 g/mol MF: C31H46N2O8
IUPAC name: [(1S,6Z,9S,9aS,10R,11aS)-6-[[tert-butyl-[2-(dimethylamino)et...
Create Date: 2015-10-06
CID: 91895947

4827. BDBM21038; 17-Hydroxywortmannin Analogue, 15; (2R,3S,6Z,14S,15S,17R)-6-({[3-(dimethylamino)propyl](methyl)amino}methylidene)-8,14,17-trihydroxy-3-(methoxymethyl)-2,15-dimethyl-4-oxatetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-1(10),7-diene-5,9-dione
MW:     504.615700 g/mol MF: C27H40N2O7
IUPAC name: (1S,6Z,9S,9aS,10R,11aS)-6-[[3-(dimethylamino)propyl-methylam...
Create Date: 2015-10-06
CID: 91895946

4828. BDBM21037; 17-Hydroxywortmannin Analogue, 14; (2R,3S,6Z,14S,15S,17R)-6-({[3-(dimethylamino)propyl]amino}methylidene)-8,14-dihydroxy-3-(methoxymethyl)-2,15-dimethyl-5,9-dioxo-4-oxatetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-1(10),7-dien-17-yl acetate
MW:     532.625800 g/mol MF: C28H40N2O8
IUPAC name: [(1S,6Z,9S,9aS,10R,11aS)-6-[[3-(dimethylamino)propylamino]me...
Create Date: 2015-10-06
CID: 91895945

4829. BDBM21036; 17-Hydroxywortmannin Analogue, 13; (2R,3S,6Z,14S,15S,17R)-6-({[3-(dimethylamino)propyl](methyl)amino}methylidene)-8,14-dihydroxy-3-(methoxymethyl)-2,15-dimethyl-5,9-dioxo-4-oxatetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-1(10),7-dien-17-yl acetate
MW:     546.652380 g/mol MF: C29H42N2O8
IUPAC name: [(1S,6Z,9S,9aS,10R,11aS)-6-[[3-(dimethylamino)propyl-methyla...
Create Date: 2015-10-06
CID: 91895944

4830. BDBM21035; Ring-opened wortmannin analogue, 4; (2R,3S,6E,15S,17R)-6-{[bis(prop-2-en-1-yl)amino]methylidene}-8-hydroxy-3-(methoxymethyl)-2,15-dimethyl-5,9,14-trioxo-4-oxatetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-1(10),7-dien-17-yl acetate
MW:     525.590100 g/mol MF: C29H35NO8
IUPAC name: [(6E,9S,9aS,10R,11aS)-6-[[bis(prop-2-enyl)amino]methylidene]...
Create Date: 2015-10-06
CID: 91895943

4831. BDBM21033; 17-Hydroxywortmannin Analogue, 12; (2R,3S,6Z,14S,15S,17R)-8,14-dihydroxy-3-(methoxymethyl)-2,15-dimethyl-5,9-dioxo-6-(pyrrolidin-1-ylmethylidene)-4-oxatetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-1(10),7-dien-17-yl acetate
MW:     501.568700 g/mol MF: C27H35NO8
IUPAC name: [(1S,6Z,9S,9aS,10R,11aS)-1-hydroxy-9-(methoxymethyl)-9a,11a-...
Create Date: 2015-10-06
CID: 91895942

4832. BDBM21032; 17-Hydroxywortmannin Analogue, 11; (2R,3S,6Z,14S,15S,17R)-6-{[butyl(methyl)amino]methylidene}-8,14-dihydroxy-3-(methoxymethyl)-2,15-dimethyl-5,9-dioxo-4-oxatetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-1(10),7-dien-17-yl acetate
MW:     517.611160 g/mol MF: C28H39NO8
IUPAC name: [(1S,6Z,9S,9aS,10R,11aS)-6-[[butyl(methyl)amino]methylidene]...
Create Date: 2015-10-06
CID: 91895941

4833. BDBM21031; 17-Hydroxywortmannin Analogue, 10; (2R,3S,6Z,14S,15S,17R)-6-[(tert-butylamino)methylidene]-8,14-dihydroxy-3-(methoxymethyl)-2,15-dimethyl-5,9-dioxo-4-oxatetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-1(10),7-dien-17-yl acetate
MW:     503.584580 g/mol MF: C27H37NO8
IUPAC name: [(1S,6Z,9S,9aS,10R,11aS)-6-[(tert-butylamino)methylidene]-1-...
Create Date: 2015-10-06
CID: 91895940

4834. UNII-785146ZYH9; 785146ZYH9; 4-MEO-AM-2201 ...
MW:     389.461963 g/mol MF: C25H24FNO2
IUPAC name: [1-(5-fluoropentyl)indol-3-yl]-(4-methoxynaphthalen-1-yl)met...
Create Date: 2015-09-11
CID: 91864522

4835. UNII-7K5H7NIL5F; 7K5H7NIL5F; N-(5-Bromopentyl) UR-144 ...
MW:     390.357120 g/mol MF: C21H28BrNO
IUPAC name: [1-(5-bromopentyl)indol-3-yl]-(2,2,3,3-tetramethylcyclopropy...
Create Date: 2015-04-28
CID: 91741279

4836. FJRCMNJZLRNCND-UHFFFAOYSA-N; JWH 122 N-(4-pentenyl) analog
MW:     353.456220 g/mol MF: C25H23NO
IUPAC name: (4-methylnaphthalen-1-yl)-(1-pent-4-enylindol-3-yl)methanone
Create Date: 2015-04-28
CID: 91725393

4837. BDBM85452; Epithioamino acid analogue, II(c); 3-[(3R)-2beta-Methylthiirane-3beta-yl]-L-alanine
MW:     161.222040 g/mol MF: C6H11NO2S
IUPAC name: (2S)-2-amino-3-[(2R,3S)-3-methylthiiran-2-yl]propanoic acid
Create Date: 2012-07-07
CID: 57340122

4838. BDBM85451; Epithioamino acid analogue, II(b); 3-[(3R)-2alpha-Methylthiirane-3beta-yl]-L-alanine
MW:     161.222040 g/mol MF: C6H11NO2S
IUPAC name: (2S)-2-amino-3-[(2R,3R)-3-methylthiiran-2-yl]propanoic acid
Create Date: 2012-07-07
CID: 57340121

4839. BDBM85450; Epithioamino acid analogue, II(a); 3-[(3R)-Thiirane-3beta-yl]-L-alanine
MW:     147.195460 g/mol MF: C5H9NO2S
IUPAC name: (2S)-2-amino-3-[(2R)-thiiran-2-yl]propanoic acid
Create Date: 2012-07-07
CID: 57340120

4840. SCHEMBL15367714; BDBM104037; Alkyl Nilutamide HDACi analog 15f
MW:     591.625150 g/mol MF: C28H36F3N7O4
IUPAC name: 9-[4-[4-[3-[4-cyano-3-(trifluoromethyl)phenyl]-5,5-dimethyl-...
Create Date: 2012-05-14
CID: 56961996

4841. SCHEMBL15362800; BDBM104036; Alkyl Nilutamide HDACi analog 15e
MW:     577.598570 g/mol MF: C27H34F3N7O4
IUPAC name: 8-[4-[4-[3-[4-cyano-3-(trifluoromethyl)phenyl]-5,5-dimethyl-...
Create Date: 2012-05-14
CID: 56961995

4842. SCHEMBL15367715; BDBM104035; Alkyl Nilutamide HDACi analog 15d
MW:     563.571990 g/mol MF: C26H32F3N7O4
IUPAC name: 7-[4-[4-[3-[4-cyano-3-(trifluoromethyl)phenyl]-5,5-dimethyl-...
Create Date: 2012-05-14
CID: 56961943

4843. SCHEMBL15362798; BDBM104034; Alkyl Nilutamide HDACi analog 15c
MW:     549.545410 g/mol MF: C25H30F3N7O4
IUPAC name: 6-[4-[4-[3-[4-cyano-3-(trifluoromethyl)phenyl]-5,5-dimethyl-...
Create Date: 2012-05-14
CID: 56961942

4844. SCHEMBL15367741; BDBM104033; Alkyl Nilutamide HDACi analog 15b
MW:     535.518830 g/mol MF: C24H28F3N7O4
IUPAC name: 5-[4-[4-[3-[4-cyano-3-(trifluoromethyl)phenyl]-5,5-dimethyl-...
Create Date: 2012-05-14
CID: 56961941

4845. SCHEMBL15362797; BDBM104032; Alkyl Nilutamide HDACi analog 15a
MW:     521.492250 g/mol MF: C23H26F3N7O4
IUPAC name: 4-[4-[4-[3-[4-cyano-3-(trifluoromethyl)phenyl]-5,5-dimethyl-...
Create Date: 2012-05-14
CID: 56961940

4846. multisubstrate analogue inhibitor 14; BDBM50017764; Phosphoric acid mono-{3-hydroxy-5-[5-(4-methyl-3,4-dihydro-2H-quinoxalin-1-ylmethyl)-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl]-tetrahydro-furan-2-ylmethyl} ester
MW:     466.381682 g/mol MF: C19H23N4O8P-2
IUPAC name: [(2R,3R)-3-hydroxy-5-[5-[(4-methyl-2,3-dihydroquinoxalin-1-y...
Create Date: 2009-11-19
CID: 44375169

4847. CHEMBL519907; BDBM30500; 1,1-dioxoisothiazole analog., 44
MW:     556.026623 g/mol MF: C23H23ClFN3O6S2
IUPAC name: N-[[(3E)-3-[1-[(3-chloro-4-fluorophenyl)methyl]-5,5-dimethyl...
Create Date: 2009-08-19
CID: 44143689

4848. CHEMBL487623; BDBM30499; 1,1-dioxoisothiazole analog., 43
MW:     570.053203 g/mol MF: C24H25ClFN3O6S2
IUPAC name: N-[[(3E)-3-[(5S)-1-[(3-chloro-4-fluorophenyl)methyl]-5-ethyl...
Create Date: 2009-08-19
CID: 44143688

4849. CHEMBL488666; BDBM30498; 1,1-dioxoisothiazole analog., 42
MW:     554.010743 g/mol MF: C23H21ClFN3O6S2
IUPAC name: N-[[(3E)-3-[4-[(3-chloro-4-fluorophenyl)methyl]-5,7-dioxo-4-...
Create Date: 2009-08-19
CID: 44143687

4850. CHEMBL529893; BDBM30497; 1,1-dioxoisothiazole analog., 41
MW:     539.984163 g/mol MF: C22H19ClFN3O6S2
IUPAC name: N-[[(3E)-3-[4-[(3-chloro-4-fluorophenyl)methyl]-5,7-dioxo-4-...
Create Date: 2009-08-19
CID: 44143686

4851. CHEMBL487446; BDBM30496; 1,1-dioxoisothiazole analog., 40
MW:     510.666560 g/mol MF: C24H34N2O6S2
IUPAC name: (3E,5S)-5-tert-butyl-1-(3,3-dimethylbutyl)-3-[7-(2-methylsul...
Create Date: 2009-08-19
CID: 44143685

4852. CHEMBL521057; BDBM30495; 1,1-dioxoisothiazole analog., 39
MW:     511.654620 g/mol MF: C23H33N3O6S2
IUPAC name: N-[[(3E)-3-[(5S)-5-tert-butyl-1-(3,3-dimethylbutyl)-2,4-diox...
Create Date: 2009-08-19
CID: 44143684

4853. CHEMBL519748; BDBM30494; 1,1-dioxoisothiazole analog., 38
MW:     502.583200 g/mol MF: C24H30N4O6S
IUPAC name: (3E,5S)-5-tert-butyl-1-(3,3-dimethylbutyl)-3-[7-(1,2,4-oxadi...
Create Date: 2009-08-19
CID: 44143683

4854. CHEMBL1162982; BDBM30493; 1,1-dioxoisothiazole analog., 37
MW:     477.573740 g/mol MF: C23H31N3O6S
IUPAC name: 2-[[(3E)-3-[(5S)-5-tert-butyl-1-(3,3-dimethylbutyl)-2,4-diox...
Create Date: 2009-08-19
CID: 44143682

4855. CHEMBL487683; BDBM30492; 1,1-dioxoisothiazole analog., 36
MW:     556.026623 g/mol MF: C23H23ClFN3O6S2
IUPAC name: N-[(3E)-3-[(5S)-5-tert-butyl-1-[(3-chloro-4-fluorophenyl)met...
Create Date: 2009-08-19
CID: 44143681

4856. CHEMBL528770; BDBM30491; 1,1-dioxoisothiazole analog., 35
MW:     584.079783 g/mol MF: C25H27ClFN3O6S2
IUPAC name: N-[[(3E)-3-[(5S)-5-tert-butyl-1-[(3-chloro-4-fluorophenyl)me...
Create Date: 2009-08-19
CID: 44143680

4857. CHEMBL511620; BDBM30489; 1,1-dioxoisothiazole analog., 33
MW:     560.981783 g/mol MF: C25H22ClFN4O6S
IUPAC name: (3E,5S)-5-tert-butyl-1-[(3-chloro-4-fluorophenyl)methyl]-3-[...
Create Date: 2009-08-19
CID: 44143679

4858. CHEMBL512483; BDBM30488; 1,1-dioxoisothiazole analog., 32
MW:     517.957043 g/mol MF: C24H21ClFN3O5S
IUPAC name: 2-[[(3E)-3-[(5S)-5-tert-butyl-1-[(3-chloro-4-fluorophenyl)me...
Create Date: 2009-08-19
CID: 44143678

4859. CHEMBL469687; BDBM30487; 1,1-dioxoisothiazole analog., 31
MW:     535.972323 g/mol MF: C24H23ClFN3O6S
IUPAC name: 2-[[(3E)-3-[(5S)-5-tert-butyl-1-[(3-chloro-4-fluorophenyl)me...
Create Date: 2009-08-19
CID: 44143677

4860. CHEMBL469457; SCHEMBL3576032; BDBM30486 ...
MW:     404.523020 g/mol MF: C21H28N2O4S
IUPAC name: (3E,5S)-5-tert-butyl-1-(3,3-dimethylbutyl)-3-(1,1-dioxo-1,2-...
Create Date: 2009-08-19
CID: 44143676

4861. CHEMBL511289; BDBM30485; 1,1-dioxoisothiazole analog., 29
MW:     434.549000 g/mol MF: C22H30N2O5S
IUPAC name: (3E,5S)-5-tert-butyl-3-(7-ethoxy-1,1-dioxo-1,2-benzothiazol-...
Create Date: 2009-08-19
CID: 44143675

4862. CHEMBL470489; BDBM30484; 1,1-dioxoisothiazole analog., 28
MW:     506.974163 g/mol MF: C24H24ClFN2O5S
IUPAC name: (3E,5S)-5-tert-butyl-1-[(3-chloro-4-fluorophenyl)methyl]-3-(...
Create Date: 2009-08-19
CID: 44143674

4863. CHEMBL470295; BDBM30483; 1,1-dioxoisothiazole analog., 27
MW:     488.983700 g/mol MF: C24H25ClN2O5S
IUPAC name: (3E,5S)-5-tert-butyl-1-[(3-chlorophenyl)methyl]-3-(7-ethoxy-...
Create Date: 2009-08-19
CID: 44143673

4864. BDBM30482; 1,1-dioxoisothiazole analog., 26
MW:     474.592940 g/mol MF: C23H26N2O5S2
IUPAC name: (3E,5R)-1-(3,3-dimethylbutyl)-3-(7-ethoxy-1,1-dioxo-1,2-benz...
Create Date: 2009-08-19
CID: 44143672

4865. CHEMBL469694; BDBM30481; 1,1-dioxoisothiazole analog., 25
MW:     474.612860 g/mol MF: C25H34N2O5S
IUPAC name: (3E,5S)-5-cyclohexyl-1-(3,3-dimethylbutyl)-3-(7-ethoxy-1,1-d...
Create Date: 2009-08-19
CID: 44143671

4866. CHEMBL471932; BDBM30480; 1,1-dioxoisothiazole analog., 24
MW:     448.575580 g/mol MF: C23H32N2O5S
IUPAC name: (3E,5S)-1-(3,3-dimethylbutyl)-3-(7-ethoxy-1,1-dioxo-1,2-benz...
Create Date: 2009-08-19
CID: 44143670

4867. CHEMBL512356; BDBM30479; 1,1-dioxoisothiazole analog., 23
MW:     448.575580 g/mol MF: C23H32N2O5S
IUPAC name: (3E,5S)-5-tert-butyl-1-(3,3-dimethylbutyl)-3-(7-ethoxy-1,1-d...
Create Date: 2009-08-19
CID: 44143669

4868. CHEMBL471931; BDBM30478; 1,1-dioxoisothiazole analog., 22
MW:     434.549000 g/mol MF: C22H30N2O5S
IUPAC name: (3E,5S)-1-(3,3-dimethylbutyl)-3-(7-ethoxy-1,1-dioxo-1,2-benz...
Create Date: 2009-08-19
CID: 44143668

4869. CHEMBL471361; BDBM30477; 1,1-dioxoisothiazole analog., 21
MW:     494.519680 g/mol MF: C24H22N4O6S
IUPAC name: (3E,5S)-1-benzyl-3-[7-(1,2,4-oxadiazol-3-ylmethoxy)-1,1-diox...
Create Date: 2009-08-19
CID: 44143667

4870. CHEMBL471360; BDBM30476; 1,1-dioxoisothiazole analog., 20
MW:     539.600060 g/mol MF: C27H29N3O7S
IUPAC name: (3E,5S)-1-benzyl-3-[7-(2-morpholin-4-yl-2-oxoethoxy)-1,1-dio...
Create Date: 2009-08-19
CID: 44143666

4871. CHEMBL512660; BDBM30475; 1,1-dioxoisothiazole analog., 19
MW:     451.494940 g/mol MF: C23H21N3O5S
IUPAC name: 2-[[(3E)-3-[(5S)-1-benzyl-2,4-dioxo-5-propan-2-ylpyrrolidin-...
Create Date: 2009-08-19
CID: 44143665

4872. CHEMBL511328; BDBM30474; 1,1-dioxoisothiazole analog., 18
MW:     510.601900 g/mol MF: C27H30N2O6S
IUPAC name: (3E,5S)-1-benzyl-3-[7-(3,3-dimethyl-2-oxobutoxy)-1,1-dioxo-1...
Create Date: 2009-08-19
CID: 44143664

4873. CHEMBL459653; BDBM30473; 1,1-dioxoisothiazole analog., 17
MW:     483.536800 g/mol MF: C24H25N3O6S
IUPAC name: 3-[[(3E)-3-[(5S)-1-benzyl-2,4-dioxo-5-propan-2-ylpyrrolidin-...
Create Date: 2009-08-19
CID: 44143663

4874. CHEMBL459652; BDBM30472; 1,1-dioxoisothiazole analog., 16
MW:     469.510220 g/mol MF: C23H23N3O6S
IUPAC name: 2-[[(3E)-3-[(5S)-1-benzyl-2,4-dioxo-5-propan-2-ylpyrrolidin-...
Create Date: 2009-08-19
CID: 44143662

4875. CHEMBL459448; BDBM30471; 1,1-dioxoisothiazole analog., 15
MW:     412.458900 g/mol MF: C21H20N2O5S
IUPAC name: (3E,5S)-1-benzyl-3-(7-hydroxy-1,1-dioxo-1,2-benzothiazol-3-y...
Create Date: 2009-08-19
CID: 44143661

4876. CHEMBL516772; BDBM30470; 1,1-dioxoisothiazole analog., 14
MW:     440.512060 g/mol MF: C23H24N2O5S
IUPAC name: (3E,5S)-1-benzyl-3-(7-ethoxy-1,1-dioxo-1,2-benzothiazol-3-yl...
Create Date: 2009-08-19
CID: 44143660

4877. CHEMBL449608; SCHEMBL5062371; BDBM28158 ...
MW:     363.432880 g/mol MF: C20H17N3O2S
IUPAC name: 5-(benzimidazol-1-yl)-3-[(3-methylphenyl)methoxy]thiophene-2...
Create Date: 2009-05-20
CID: 25263076

4878. CHEMBL518956; SCHEMBL4041917; BDBM28157 ...
MW:     363.432880 g/mol MF: C20H17N3O2S
IUPAC name: 5-(benzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]thiophene-2...
Create Date: 2009-05-20
CID: 25263075

4879. CHEMBL481724; SCHEMBL4037261; BDBM28156 ...
MW:     349.406300 g/mol MF: C19H15N3O2S
IUPAC name: 5-(benzimidazol-1-yl)-3-phenylmethoxythiophene-2-carboxamide
Create Date: 2009-05-20
CID: 25263074

4880. CHEMBL512049; BDBM26607; furan carboxylic acid analogue, 32 ...
MW:     310.322360 g/mol MF: C14H14O6S
IUPAC name: 5-[(4-carboxy-5-methylfuran-2-yl)methylsulfanylmethyl]-3-met...
Create Date: 2009-03-16
CID: 25190438

4881. CHEMBL444543; BDBM26007; cyclopropylmethyl amide analog., 29 ...
MW:     347.410340 g/mol MF: C21H21N3O2
IUPAC name: N-(cyclopropylmethyl)-3-methyl-4-[3-(5-methyl-1,3,4-oxadiazo...
Create Date: 2008-12-11
CID: 25093475

4882. GW734508X; CHEMBL257113; BDBM26006 ...
MW:     333.383760 g/mol MF: C20H19N3O2
IUPAC name: N-(cyclopropylmethyl)-4-[3-(5-methyl-1,3,4-oxadiazol-2-yl)ph...
Create Date: 2008-12-11
CID: 25093474

4883. 1006878-14-3; CHEMBL257303; BDBM26005 ...
MW:     346.425580 g/mol MF: C21H22N4O
IUPAC name: N-(cyclopropylmethyl)-4-[2-methyl-5-(5-methyl-1H-1,2,4-triaz...
Create Date: 2008-12-11
CID: 25093473

4884. CHEMBL401530; BDBM26004; cyclopropylmethyl amide analog., 26 ...
MW:     331.410940 g/mol MF: C21H21N3O
IUPAC name: N-(cyclopropylmethyl)-4-[5-(1H-imidazol-2-yl)-2-methylphenyl...
Create Date: 2008-12-11
CID: 25093472

4885. CHEMBL272308; BDBM26003; cyclopropylmethyl amide analog., 25 ...
MW:     347.410340 g/mol MF: C21H21N3O2
IUPAC name: N-(cyclopropylmethyl)-4-[2-methyl-5-(5-methyl-1,2,4-oxadiazo...
Create Date: 2008-12-11
CID: 25093471

4886. CHEMBL257918; BDBM26002; cyclopropylmethyl amide analog., 24 ...
MW:     389.490080 g/mol MF: C24H27N3O2
IUPAC name: 4-[5-(5-butyl-1,3,4-oxadiazol-2-yl)-2-methylphenyl]-N-(cyclo...
Create Date: 2008-12-11
CID: 25093470

4887. CHEMBL403860; BDBM25999; cyclopropylmethyl amide analog., 21 ...
MW:     333.383760 g/mol MF: C20H19N3O2
IUPAC name: N-(cyclopropylmethyl)-4-[2-methyl-5-(1,3,4-oxadiazol-2-yl)ph...
Create Date: 2008-12-11
CID: 25093469

4888. ethyl N-{5-[(E)-2-(4-hydroxyphenyl)ethenyl]-1H-1,3-benzodiazol-2-yl}carbamate; AC1Q35CE; CHEMBL471145 ...
MW:     323.345880 g/mol MF: C18H17N3O3
IUPAC name: ethyl N-[6-[(E)-2-(4-hydroxyphenyl)ethenyl]-1H-benzimidazol-...
Create Date: 2008-10-21
CID: 24971303

4889. 3d5m; SCHEMBL3579792; BDBM30490 ...
MW:     570.053203 g/mol MF: C24H25ClFN3O6S2
IUPAC name: N-[[(3E)-3-[(5S)-5-tert-butyl-1-[(3-chloro-4-fluorophenyl)me...
Create Date: 2008-09-15
CID: 24894099

4890. CHEMBL409714; BDBM21612; Spiro-indolinone analogue, (R)-90 ...
MW:     437.248503 g/mol MF: C20H15Cl2FN2O4
IUPAC name: 2-[(3R)-5-chloro-1'-[(5-chloro-2-fluorophenyl)methyl]-2,2'-d...
Create Date: 2008-05-08
CID: 24776308

4891. CHEMBL260013; BDBM21611; Spiro-indolinone analogue, (S)-90 ...
MW:     437.248503 g/mol MF: C20H15Cl2FN2O4
IUPAC name: 2-[(3S)-5-chloro-1'-[(5-chloro-2-fluorophenyl)methyl]-2,2'-d...
Create Date: 2008-05-08
CID: 24776307

4892. CHEMBL260672; SCHEMBL2483474; BDBM21610 ...
MW:     451.232023 g/mol MF: C20H13Cl2FN2O5
IUPAC name: 2-[(3R)-5-chloro-1'-[(5-chloro-2-fluorophenyl)methyl]-2,2',5...
Create Date: 2008-05-08
CID: 24776306

4893. CHEMBL261547; SCHEMBL2481862; BDBM21609 ...
MW:     451.232023 g/mol MF: C20H13Cl2FN2O5
IUPAC name: 2-[(3S)-5-chloro-1'-[(5-chloro-2-fluorophenyl)methyl]-2,2',5...
Create Date: 2008-05-08
CID: 24776305

4894. CHEMBL259520; SCHEMBL2485354; BDBM21607 ...
MW:     428.822480 g/mol MF: C21H17ClN2O6
IUPAC name: 2-[(3R)-5-chloro-1'-[(3-methoxyphenyl)methyl]-2,2',5'-trioxo...
Create Date: 2008-05-08
CID: 24776304

4895. CHEMBL261730; SCHEMBL2481369; BDBM21604 ...
MW:     416.786963 g/mol MF: C20H14ClFN2O5
IUPAC name: 2-[(3S)-5-chloro-1'-[(2-fluorophenyl)methyl]-2,2',5'-trioxos...
Create Date: 2008-05-08
CID: 24776303

4896. CHEMBL260674; SCHEMBL2482377; BDBM21603 ...
MW:     416.786963 g/mol MF: C20H14ClFN2O5
IUPAC name: 2-[(3R)-5-chloro-1'-[(2-fluorophenyl)methyl]-2,2',5'-trioxos...
Create Date: 2008-05-08
CID: 24776302

4897. CHEMBL260726; SCHEMBL2480564; BDBM21602 ...
MW:     398.796500 g/mol MF: C20H15ClN2O5
IUPAC name: 2-[(3S)-1'-benzyl-5-chloro-2,2',5'-trioxospiro[indole-3,3'-p...
Create Date: 2008-05-08
CID: 24776301

4898. CHEMBL260727; SCHEMBL2482406; BDBM21601 ...
MW:     398.796500 g/mol MF: C20H15ClN2O5
IUPAC name: 2-[(3R)-1'-benzyl-5-chloro-2,2',5'-trioxospiro[indole-3,3'-p...
Create Date: 2008-05-08
CID: 24776300

4899. CHEMBL259463; SCHEMBL2077356; BDBM21288 ...
MW:     418.367220 g/mol MF: C22H28BrNO2
IUPAC name: [5-bromo-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3-tetramethyl...
Create Date: 2008-04-23
CID: 24768491

4900. CHEMBL410676; SCHEMBL2076323; BDBM21287 ...
MW:     373.916220 g/mol MF: C22H28ClNO2
IUPAC name: [5-chloro-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3-tetramethy...
Create Date: 2008-04-23
CID: 24768490

4901. CHEMBL410677; SCHEMBL2077281; BDBM21286 ...
MW:     357.461623 g/mol MF: C22H28FNO2
IUPAC name: [5-fluoro-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3-tetramethy...
Create Date: 2008-04-23
CID: 24768489

4902. CHEMBL409669; SCHEMBL2076428; BDBM21285 ...
MW:     411.433013 g/mol MF: C22H25F4NO2
IUPAC name: [4,5,6,7-tetrafluoro-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3...
Create Date: 2008-04-23
CID: 24768488

4903. CHEMBL397800; BDBM22999; N-arachidonoylserotonin analogue, 1l ...
MW:     364.480620 g/mol MF: C23H28N2O2
IUPAC name: N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-2-(3-pentylphenyl)aceta...
Create Date: 2008-03-17
CID: 24749373

4904. CHEMBL397071; BDBM22998; N-arachidonoylserotonin analogue, 1k ...
MW:     392.533780 g/mol MF: C25H32N2O2
IUPAC name: N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-9-phenylnonanamide
Create Date: 2008-03-17
CID: 24749273

4905. CHEMBL394637; BDBM22997; N-arachidonoylserotonin analogue, 1j ...
MW:     378.507200 g/mol MF: C24H30N2O2
IUPAC name: N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-8-phenyloctanamide
Create Date: 2008-03-17
CID: 24749272

4906. CHEMBL394636; BDBM22995; N-arachidonoylserotonin analogue, 1h ...
MW:     358.517560 g/mol MF: C22H34N2O2
IUPAC name: N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]dodecanamide
Create Date: 2008-03-17
CID: 24749271

4907. N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]undecanamide; CHEMBL394635; BDBM22994 ...
MW:     344.490980 g/mol MF: C21H32N2O2
IUPAC name: N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]undecanamide
Create Date: 2008-03-17
CID: 24749270

4908. CHEMBL238325; BDBM22993; N-arachidonoylserotonin analogue, 1f ...
MW:     364.525360 g/mol MF: C18H24N2O2S2
IUPAC name: 5-(dithiolan-3-yl)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]penta...
Create Date: 2008-03-17
CID: 24749269

4909. Oleoyl Serotonin; 1002100-44-8; N-(2-(5-Hydroxy-1H-indol-3-yl)ethyl)-9Z-octadecenamide ...
MW:     440.661160 g/mol MF: C28H44N2O2
IUPAC name: (Z)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]octadec-9-enamide
Create Date: 2008-03-17
CID: 24749268

4910. CHEMBL236385; BDBM22991; N-arachidonoylserotonin analogue, 1d ...
MW:     438.645280 g/mol MF: C28H42N2O2
IUPAC name: (9Z,12Z)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]octadeca-9,12-d...
Create Date: 2008-03-17
CID: 24749267

4911. CHEMBL392299; BDBM22990; N-arachidonoylserotonin analogue, 1c ...
MW:     436.629400 g/mol MF: C28H40N2O2
IUPAC name: (6Z,9Z,12Z)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]octadeca-6,9...
Create Date: 2008-03-17
CID: 24749163

4912. CHEMBL393943; BDBM22989; N-arachidonoylserotonin analogue, 1b ...
MW:     436.629400 g/mol MF: C28H40N2O2
IUPAC name: (9Z,12Z,15Z)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]octadeca-9,...
Create Date: 2008-03-17
CID: 24749162

4913. CHEMBL203004; BDBM15110; trans-bispyridinylethylene analog 6e ...
MW:     331.410940 g/mol MF: C21H21N3O
IUPAC name: (2S)-1-phenyl-3-[5-[(E)-2-pyridin-4-ylethenyl]pyridin-2-yl]o...
Create Date: 2008-01-19
CID: 23646986

4914. CHEMBL204447; BDBM15109; trans-bispyridinylethylene analog 6d ...
MW:     331.410940 g/mol MF: C21H21N3O
IUPAC name: (2S)-1-phenyl-3-[4-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl]o...
Create Date: 2008-01-19
CID: 23646985

4915. CHEMBL206654; BDBM15108; trans-bispyridinylethylene analog 6c ...
MW:     370.446980 g/mol MF: C23H22N4O
IUPAC name: (2S)-1-(1H-indol-3-yl)-3-[6-[(E)-2-pyridin-4-ylethenyl]pyrid...
Create Date: 2008-01-19
CID: 23646984

4916. CHEMBL206444; BDBM15107; trans-bispyridinylethylene analog 6b ...
MW:     370.446980 g/mol MF: C23H22N4O
IUPAC name: (2S)-1-(1H-indol-3-yl)-3-[4-[(E)-2-pyridin-4-ylethenyl]pyrid...
Create Date: 2008-01-19
CID: 23646983

4917. CHEMBL262986; BDBM15106; trans-bispyridinylethylene analog 6a ...
MW:     369.458920 g/mol MF: C24H23N3O
IUPAC name: (2S)-1-(1H-indol-3-yl)-3-[3-[(E)-2-pyridin-4-ylethenyl]pheno...
Create Date: 2008-01-19
CID: 23646982

4918. CHEMBL383843; BDBM15105; trans-bispyridinylethylene analog 5 ...
MW:     369.458920 g/mol MF: C24H23N3O
IUPAC name: (2S)-1-(1H-indol-3-yl)-3-[5-[(E)-2-phenylethenyl]pyridin-3-y...
Create Date: 2008-01-19
CID: 23646981

4919. CHEMBL205836; BDBM15093; trans-bispyridinylethylene analog 7b ...
MW:     355.432340 g/mol MF: C23H21N3O
IUPAC name: 3-[3-[5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl]oxypropyl]-1...
Create Date: 2008-01-19
CID: 23646973

4920. CHEMBL203685; BDBM15081; trans-bispyridinylethylene analog 2l ...
MW:     347.410340 g/mol MF: C21H21N3O2
IUPAC name: 3-[(2S)-2-amino-3-[5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl...
Create Date: 2008-01-19
CID: 23646972

4921. CHEMBL203583; BDBM15080; trans-bispyridinylethylene analog 2k ...
MW:     410.467780 g/mol MF: C25H22N4O2
IUPAC name: (2R)-2-amino-N-naphthalen-2-yl-3-[5-[(E)-2-pyridin-4-ylethen...
Create Date: 2008-01-19
CID: 23646971

4922. CHEMBL381829; BDBM15078; trans-bispyridinylethylene analog 2i ...
MW:     345.437520 g/mol MF: C22H23N3O
IUPAC name: (2S)-4-phenyl-1-[5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl]o...
Create Date: 2008-01-19
CID: 23646970

4923. CHEMBL378166; BDBM15073; trans-bispyridinylethylene analog 2d ...
MW:     285.297900 g/mol MF: C15H15N3O3
IUPAC name: (2R)-2-amino-3-[5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl]ox...
Create Date: 2008-01-19
CID: 23646969

4924. CHEMBL218723; BDBM12749; dihydropyrazolopyridinone analogue 8f ...
MW:     556.556130 g/mol MF: C27H23F3N4O4S
IUPAC name: 1-(2-amino-4-methoxyphenyl)-6-[4-(2-methylsulfonylphenyl)phe...
Create Date: 2008-01-19
CID: 23646187

4925. CHEMBL374306; SCHEMBL14176196; BDBM12748 ...
MW:     620.619930 g/mol MF: C27H23F3N4O6S2
IUPAC name: 5-methoxy-2-[6-[4-(2-methylsulfonylphenyl)phenyl]-7-oxo-3-(t...
Create Date: 2008-01-19
CID: 23646186

4926. CHEMBL221377; SCHEMBL5093526; BDBM12747 ...
MW:     584.566230 g/mol MF: C28H23F3N4O5S
IUPAC name: 5-methoxy-2-[6-[4-(2-methylsulfonylphenyl)phenyl]-7-oxo-3-(t...
Create Date: 2008-01-19
CID: 23646185

4927. CHEMBL221913; BDBM12746; dihydropyrazolopyridinone analogue 8c ...
MW:     541.541490 g/mol MF: C27H22F3N3O4S
IUPAC name: 1-(4-methoxyphenyl)-6-[4-(2-methylsulfonylphenyl)phenyl]-3-(...
Create Date: 2008-01-19
CID: 23646184

4928. CHEMBL218659; SCHEMBL5100003; BDBM12745 ...
MW:     554.540250 g/mol MF: C27H21F3N4O4S
IUPAC name: 2-[6-[4-(2-methylsulfonylphenyl)phenyl]-7-oxo-3-(trifluorome...
Create Date: 2008-01-19
CID: 23646183

4929. CHEMBL376710; SCHEMBL14176209; BDBM12744 ...
MW:     590.593950 g/mol MF: C26H21F3N4O5S2
IUPAC name: 2-[6-[4-(2-methylsulfonylphenyl)phenyl]-7-oxo-3-(trifluorome...
Create Date: 2008-01-19
CID: 23646182

4930. CHEMBL221296; BDBM12743; dihydropyrazolopyridinone analogue 7c ...
MW:     562.582170 g/mol MF: C31H29F3N4O3
IUPAC name: 6-[4-[2-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]phenyl]phenyl...
Create Date: 2008-01-19
CID: 23646181

4931. CHEMBL374304; SCHEMBL14176205; BDBM12741 ...
MW:     611.634630 g/mol MF: C30H28F3N5O4S
IUPAC name: 2-[6-[4-[2-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]phenyl]phe...
Create Date: 2008-01-19
CID: 23646180

4932. CHEMBL376227; BDBM12739; dihydropyrazolopyridinone analogue 6j ...
MW:     518.572670 g/mol MF: C30H29F3N4O
IUPAC name: 6-[4-[2-[(dimethylamino)methyl]phenyl]phenyl]-1-(4-ethylphen...
Create Date: 2008-01-19
CID: 23646179

4933. CHEMBL221911; BDBM12738; dihydropyrazolopyridinone analogue 6i ...
MW:     583.624530 g/mol MF: C29H28F3N5O3S
IUPAC name: N-[3-[6-[4-[2-[(dimethylamino)methyl]phenyl]phenyl]-7-oxo-3-...
Create Date: 2008-01-19
CID: 23646178

4934. CHEMBL376622; BDBM12737; dihydropyrazolopyridinone analogue 6h ...
MW:     548.558890 g/mol MF: C29H27F3N6O2
IUPAC name: [3-[6-[4-[2-[(dimethylamino)methyl]phenyl]phenyl]-7-oxo-3-(t...
Create Date: 2008-01-19
CID: 23646177

4935. CHEMBL221028; BDBM12736; dihydropyrazolopyridinone analogue 6g ...
MW:     547.570830 g/mol MF: C30H28F3N5O2
IUPAC name: N-[3-[6-[4-[2-[(dimethylamino)methyl]phenyl]phenyl]-7-oxo-3-...
Create Date: 2008-01-19
CID: 23646176

4936. CHEMBL221968; BDBM12735; dihydropyrazolopyridinone analogue 6f ...
MW:     505.534150 g/mol MF: C28H26F3N5O
IUPAC name: 1-(3-aminophenyl)-6-[4-[2-[(dimethylamino)methyl]phenyl]phen...
Create Date: 2008-01-19
CID: 23646175

4937. CHEMBL384769; BDBM12734; dihydropyrazolopyridinone analogue 6e ...
MW:     535.517070 g/mol MF: C28H24F3N5O3
IUPAC name: 6-[4-[2-[(dimethylamino)methyl]phenyl]phenyl]-1-(3-nitrophen...
Create Date: 2008-01-19
CID: 23646174

4938. CHEMBL221092; BDBM12732; dihydropyrazolopyridinone analogue 6c ...
MW:     515.528970 g/mol MF: C29H24F3N5O
IUPAC name: 3-[6-[4-[2-[(dimethylamino)methyl]phenyl]phenyl]-7-oxo-3-(tr...
Create Date: 2008-01-19
CID: 23646173

4939. CHEMBL385756; BDBM12731; dihydropyrazolopyridinone analogue 6b ...
MW:     533.544250 g/mol MF: C29H26F3N5O2
IUPAC name: 2-[6-[4-[2-[(dimethylamino)methyl]phenyl]phenyl]-7-oxo-3-(tr...
Create Date: 2008-01-19
CID: 23646172

4940. CHEMBL374187; SCHEMBL14176204; BDBM12730 ...
MW:     569.597950 g/mol MF: C28H26F3N5O3S
IUPAC name: 2-[6-[4-[2-[(dimethylamino)methyl]phenyl]phenyl]-7-oxo-3-(tr...
Create Date: 2008-01-19
CID: 23646171

4941. BDBM12044; benzyloxycarbonyl (CBZ) analogue 5; (3S)-3-{[(benzyloxy)carbonyl]amino}-4-oxo-5-[(3-phenylpropyl)sulfanyl]pentanoic acid ...
MW:     415.502600 g/mol MF: C22H25NO5S
IUPAC name: (3S)-4-oxo-3-(phenylmethoxycarbonylamino)-5-(3-phenylpropyls...
Create Date: 2008-01-19
CID: 23645961

4942. BDBM12043; benzyloxycarbonyl (CBZ) analogue 3; (S)-3-Benzyloxycarbonylamino-4-oxo-9-phenyl-nonanoic acid ...
MW:     397.464180 g/mol MF: C23H27NO5
IUPAC name: (3S)-4-oxo-9-phenyl-3-(phenylmethoxycarbonylamino)nonanoic a...
Create Date: 2008-01-19
CID: 23645960

4943. BDBM11703; (2S)-Cyanopyrrolidine analogue 18g; 1-{4-[3-({2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl}amino)propanoyl]piperazin-1-yl}-1,6-dihydropyridine-3-carbonitrile
MW:     397.474080 g/mol MF: C20H27N7O2
IUPAC name: 1-[4-[3-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl]amino]p...
Create Date: 2008-01-19
CID: 23645753

4944. CHEMBL235906; BDBM19019; trifluoromethylpyrazole analogue, 37 ...
MW:     470.486810 g/mol MF: C25H25F3N4O2
IUPAC name: 1-(4-methoxyphenyl)-6-(4-piperidin-1-ylphenyl)-3-(trifluorom...
Create Date: 2008-01-07
CID: 23635386

4945. CHEMBL428199; BDBM19015; trifluoromethylpyrazole analogue, 35 ...
MW:     444.406470 g/mol MF: C22H19F3N4O3
IUPAC name: N-[4-[1-(4-methoxyphenyl)-7-oxo-3-(trifluoromethyl)-4,5-dihy...
Create Date: 2008-01-07
CID: 23635262

4946. CHEMBL393727; BDBM19014; trifluoromethylpyrazole analogue, 34 ...
MW:     402.369790 g/mol MF: C20H17F3N4O2
IUPAC name: 6-(4-aminophenyl)-1-(4-methoxyphenyl)-3-(trifluoromethyl)-4,...
Create Date: 2008-01-07
CID: 23635261

4947. CHEMBL205645; BDBM15075; trans-bispyridinylethylene analog 2f ...
MW:     281.352260 g/mol MF: C17H19N3O
IUPAC name: 3-[(E)-2-pyridin-4-ylethenyl]-5-[[(2S)-pyrrolidin-2-yl]metho...
Create Date: 2007-12-05
CID: 22961870

4948. CHEMBL204213; BDBM15074; trans-bispyridinylethylene analog 2e ...
MW:     267.325680 g/mol MF: C16H17N3O
IUPAC name: 3-[[(2S)-azetidin-2-yl]methoxy]-5-[(E)-2-pyridin-4-ylethenyl...
Create Date: 2007-12-05
CID: 22872615

4949. CHEMBL205820; BDBM15071; trans-bispyridinylethylene analog 2b ...
MW:     255.314980 g/mol MF: C15H17N3O
IUPAC name: 3-[5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl]oxypropan-1-ami...
Create Date: 2007-12-05
CID: 22607483

4950. CHEMBL206382; BDBM15070; trans-bispyridinylethylene analog 2a ...
MW:     241.288400 g/mol MF: C14H15N3O
IUPAC name: 2-[5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl]oxyethanamine
Create Date: 2007-12-05
CID: 22607234

4951. CHEMBL272519; SCHEMBL5456110; BDBM26000 ...
MW:     361.436920 g/mol MF: C22H23N3O2
IUPAC name: N-(cyclopropylmethyl)-4-[5-(5-ethyl-1,3,4-oxadiazol-2-yl)-2-...
Create Date: 2007-12-05
CID: 21078794

4952. CHEMBL404913; SCHEMBL5465612; BDBM26001 ...
MW:     375.463500 g/mol MF: C23H25N3O2
IUPAC name: N-(cyclopropylmethyl)-4-[2-methyl-5-(5-propyl-1,3,4-oxadiazo...
Create Date: 2007-12-05
CID: 21078793

4953. CHEMBL202893; BDBM15091; trans-bispyridinylethylene analog 2v ...
MW:     398.500140 g/mol MF: C25H26N4O
IUPAC name: (2S)-1-(1H-indol-3-yl)-N,N-dimethyl-3-[5-[(E)-2-pyridin-4-yl...
Create Date: 2007-12-05
CID: 20744810

4954. pyridine-base inhibitor 1a; CHEMBL203673; BDBM15021 ...
MW:     331.410940 g/mol MF: C21H21N3O
IUPAC name: (2S)-1-phenyl-3-[5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl]o...
Create Date: 2007-12-05
CID: 20744808

4955. CHEMBL204059; BDBM15072; trans-bispyridinylethylene analog 2c ...
MW:     283.368140 g/mol MF: C17H21N3O
IUPAC name: (2S)-3-methyl-1-[5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl]o...
Create Date: 2007-12-05
CID: 20744806

4956. CHEMBL205410; BDBM15082; trans-bispyridinylethylene analog 2m ...
MW:     356.420400 g/mol MF: C22H20N4O
IUPAC name: 3-[(2S)-2-amino-3-[5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl...
Create Date: 2007-12-05
CID: 20744801

4957. CHEMBL205871; BDBM15083; trans-bispyridinylethylene analog 2n ...
MW:     381.469620 g/mol MF: C25H23N3O
IUPAC name: (2S)-1-naphthalen-1-yl-3-[5-[(E)-2-pyridin-4-ylethenyl]pyrid...
Create Date: 2007-12-05
CID: 20744799

4958. CHEMBL204012; BDBM15090; trans-bispyridinylethylene analog 2u ...
MW:     384.473560 g/mol MF: C24H24N4O
IUPAC name: (2S)-1-(1-methylindol-3-yl)-3-[5-[(E)-2-pyridin-4-ylethenyl]...
Create Date: 2007-12-05
CID: 20744797

4959. CHEMBL376113; BDBM22414; WIN 35,065-2 Analogue, 4r ...
MW:     443.431760 g/mol MF: C24H24Cl2N2S
IUPAC name: 5-(3,4-dichlorophenyl)-2-[(1S,3S,4S,5R)-8-methyl-3-(4-methyl...
Create Date: 2007-10-15
CID: 16748951

4960. CHEMBL229381; BDBM22409; WIN 35,065-2 Analogue, 4l ...
MW:     408.986700 g/mol MF: C24H25ClN2S
IUPAC name: 5-(4-chlorophenyl)-2-[(1S,3S,4S,5R)-8-methyl-3-(4-methylphen...
Create Date: 2007-10-15
CID: 16748950

4961. CHEMBL388612; BDBM22406; WIN 35,065-2 Analogue, 4i ...
MW:     463.850240 g/mol MF: C23H21Cl3N2S
IUPAC name: 2-[(1S,3S,4S,5R)-3-(4-chlorophenyl)-8-methyl-8-azabicyclo[3....
Create Date: 2007-10-15
CID: 16748949

4962. CHEMBL227231; BDBM22402; WIN 35,065-2 Analogue, 4e ...
MW:     473.856180 g/mol MF: C23H22BrClN2S
IUPAC name: 5-(3-bromophenyl)-2-[(1S,3S,4S,5R)-3-(4-chlorophenyl)-8-meth...
Create Date: 2007-10-15
CID: 16748849

4963. CHEMBL390743; BDBM22399; WIN 35,065-2 Analogue, 4b ...
MW:     412.950583 g/mol MF: C23H22ClFN2S
IUPAC name: 2-[(1S,3S,4S,5R)-3-(4-chlorophenyl)-8-methyl-8-azabicyclo[3....
Create Date: 2007-10-15
CID: 16748848

4964. CHEMBL436132; BDBM22410; WIN 35,065-2 Analogue, 4n ...
MW:     453.437700 g/mol MF: C24H25BrN2S
IUPAC name: 5-(3-bromophenyl)-2-[(1S,3S,4S,5R)-8-methyl-3-(4-methylpheny...
Create Date: 2007-10-15
CID: 16748731

4965. CHEMBL227315; BDBM20576; Piperazinylpyrimidine analogue, 16l ...
MW:     488.604520 g/mol MF: C26H28N6O2S
IUPAC name: N-[4-[6-[4-(2-phenylpropan-2-yl)piperazin-1-yl]pyrimidin-4-y...
Create Date: 2007-10-15
CID: 16748693

4966. CHEMBL387511; BDBM20575; Piperazinylpyrimidine analogue, 16k ...
MW:     536.647320 g/mol MF: C30H28N6O2S
IUPAC name: N-[4-[6-(4-benzhydrylpiperazin-1-yl)pyrimidin-4-yl]oxy-1,3-b...
Create Date: 2007-10-15
CID: 16748692

4967. CHEMBL388760; BDBM22404; WIN 35,065-2 Analogue, 4g ...
MW:     439.957680 g/mol MF: C23H22ClN3O2S
IUPAC name: 2-[(1S,3S,4S,5R)-3-(4-chlorophenyl)-8-methyl-8-azabicyclo[3....
Create Date: 2007-10-15
CID: 16748623

4968. CHEMBL227261; BDBM20574; Piperazinylpyrimidine analogue, 16j ...
MW:     488.604520 g/mol MF: C26H28N6O2S
IUPAC name: N-[4-[6-[4-(1-phenylpropyl)piperazin-1-yl]pyrimidin-4-yl]oxy...
Create Date: 2007-10-15
CID: 16748583

4969. CHEMBL227260; SCHEMBL1039008; BDBM20573 ...
MW:     474.577940 g/mol MF: C25H26N6O2S
IUPAC name: N-[4-[6-[4-(1-phenylethyl)piperazin-1-yl]pyrimidin-4-yl]oxy-...
Create Date: 2007-10-15
CID: 16748582

4970. CHEMBL389260; BDBM20572; Piperazinylpyrimidine analogue, 16h ...
MW:     474.577940 g/mol MF: C25H26N6O2S
IUPAC name: N-[4-[6-[4-(2-phenylethyl)piperazin-1-yl]pyrimidin-4-yl]oxy-...
Create Date: 2007-10-15
CID: 16748581

4971. CHEMBL227209; BDBM20569; Piperazinylpyrimidine analogue, 16e ...
MW:     452.453370 g/mol MF: C19H19F3N6O2S
IUPAC name: N-[4-[6-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]pyrimidin-4-...
Create Date: 2007-10-15
CID: 16748580

4972. CHEMBL389259; BDBM20568; Piperazinylpyrimidine analogue, 16d ...
MW:     440.561720 g/mol MF: C22H28N6O2S
IUPAC name: N-[4-[6-[4-(2,2-dimethylpropyl)piperazin-1-yl]pyrimidin-4-yl...
Create Date: 2007-10-15
CID: 16748579

4973. CHEMBL387489; BDBM20567; Piperazinylpyrimidine analogue, 16c
MW:     426.535140 g/mol MF: C21H26N6O2S
IUPAC name: N-[4-[6-(4-tert-butylpiperazin-1-yl)pyrimidin-4-yl]oxy-1,3-b...
Create Date: 2007-10-15
CID: 16748578

4974. CHEMBL2113279; BDBM22415; WIN 35,065-2 Analogue, 4s ...
MW:     434.593600 g/mol MF: C26H30N2O2S
IUPAC name: 5-(3,4-dimethoxyphenyl)-2-[(1S,3S,4S,5R)-8-methyl-3-(4-methy...
Create Date: 2007-10-15
CID: 16748513

4975. CHEMBL226933; BDBM22413; WIN 35,065-2 Analogue, 4q ...
MW:     404.567620 g/mol MF: C25H28N2OS
IUPAC name: 5-(4-methoxyphenyl)-2-[(1S,3S,4S,5R)-8-methyl-3-(4-methylphe...
Create Date: 2007-10-15
CID: 16748512

4976. CHEMBL227207; SCHEMBL14276267; BDBM20566 ...
MW:     412.508560 g/mol MF: C20H24N6O2S
IUPAC name: N-[4-[6-(4-propan-2-ylpiperazin-1-yl)pyrimidin-4-yl]oxy-1,3-...
Create Date: 2007-10-15
CID: 16748469

4977. CHEMBL227154; SCHEMBL3842439; BDBM20565 ...
MW:     370.428820 g/mol MF: C17H18N6O2S
IUPAC name: N-[4-(6-piperazin-1-ylpyrimidin-4-yl)oxy-1,3-benzothiazol-2-...
Create Date: 2007-10-15
CID: 16748468

4978. CHEMBL229436; BDBM22411; WIN 35,065-2 Analogue, 4o ...
MW:     419.539200 g/mol MF: C24H25N3O2S
IUPAC name: 2-[(1S,3S,4S,5R)-8-methyl-3-(4-methylphenyl)-8-azabicyclo[3....
Create Date: 2007-10-15
CID: 16748383

4979. CHEMBL229699; BDBM22408; WIN 35,065-2 Analogue, 4k ...
MW:     392.532103 g/mol MF: C24H25FN2S
IUPAC name: 5-(4-fluorophenyl)-2-[(1S,3S,4S,5R)-8-methyl-3-(4-methylphen...
Create Date: 2007-10-15
CID: 16748382

4980. CHEMBL388832; BDBM22407; WIN 35,065-2 Analogue, 4j ...
MW:     455.012080 g/mol MF: C25H27ClN2O2S
IUPAC name: 2-[(1S,3S,4S,5R)-3-(4-chlorophenyl)-8-methyl-8-azabicyclo[3....
Create Date: 2007-10-15
CID: 16748381

4981. CHEMBL226984; BDBM22412; WIN 35,065-2 Analogue, 4p ...
MW:     419.539200 g/mol MF: C24H25N3O2S
IUPAC name: 2-[(1S,3S,4S,5R)-8-methyl-3-(4-methylphenyl)-8-azabicyclo[3....
Create Date: 2007-10-15
CID: 16748165

4982. CHEMBL375685; BDBM22419; WIN 35,065-2 Analogue, 4m ...
MW:     453.437700 g/mol MF: C24H25BrN2S
IUPAC name: 5-(4-bromophenyl)-2-[(1S,3S,4S,5R)-8-methyl-3-(4-methylpheny...
Create Date: 2007-10-15
CID: 16748007

4983. CHEMBL227233; BDBM22405; WIN 35,065-2 Analogue, 4h ...
MW:     424.986100 g/mol MF: C24H25ClN2OS
IUPAC name: 2-[(1S,3S,4S,5R)-3-(4-chlorophenyl)-8-methyl-8-azabicyclo[3....
Create Date: 2007-10-15
CID: 16748006

4984. CHEMBL227232; BDBM22403; WIN 35,065-2 Analogue, 4f ...
MW:     439.957680 g/mol MF: C23H22ClN3O2S
IUPAC name: 2-[(1S,3S,4S,5R)-3-(4-chlorophenyl)-8-methyl-8-azabicyclo[3....
Create Date: 2007-10-15
CID: 16748005

4985. CHEMBL388759; BDBM22401; WIN 35,065-2 Analogue, 4d ...
MW:     473.856180 g/mol MF: C23H22BrClN2S
IUPAC name: 5-(4-bromophenyl)-2-[(1S,3S,4S,5R)-3-(4-chlorophenyl)-8-meth...
Create Date: 2007-10-15
CID: 16748004

4986. CHEMBL227180; BDBM22400; WIN 35,065-2 Analogue, 4c ...
MW:     429.405180 g/mol MF: C23H22Cl2N2S
IUPAC name: 5-(4-chlorophenyl)-2-[(1S,3S,4S,5R)-3-(4-chlorophenyl)-8-met...
Create Date: 2007-10-15
CID: 16747877

4987. CHEMBL388134; SCHEMBL3395598; BDBM20803 ...
MW:     346.814660 g/mol MF: C16H19ClN6O
IUPAC name: 6-chloro-9-[(3,5-dimethyl-4-propan-2-yloxypyridin-2-yl)methy...
Create Date: 2007-09-27
CID: 16737556

4988. CHEMBL229576; SCHEMBL3396095; BDBM20812 ...
MW:     302.762100 g/mol MF: C14H15ClN6
IUPAC name: 6-chloro-9-[(3,4,5-trimethylpyridin-2-yl)methyl]purin-2-amin...
Create Date: 2007-09-27
CID: 16736767

4989. CHEMBL228407; SCHEMBL3391765; BDBM20810 ...
MW:     303.750160 g/mol MF: C13H14ClN7
IUPAC name: 9-[(4-amino-3,5-dimethylpyridin-2-yl)methyl]-6-chloropurin-2...
Create Date: 2007-09-27
CID: 16736766

4990. CHEMBL229891; SCHEMBL1395344; BDBM20806 ...
MW:     323.180580 g/mol MF: C13H12Cl2N6
IUPAC name: 6-chloro-9-[(4-chloro-3,5-dimethylpyridin-2-yl)methyl]purin-...
Create Date: 2007-09-27
CID: 16736765

4991. CHEMBL229638; SCHEMBL3393681; BDBM20787 ...
MW:     319.746260 g/mol MF: C14H14ClN5O2
IUPAC name: 6-chloro-9-[(2,5-dimethoxyphenyl)methyl]purin-2-amine
Create Date: 2007-09-27
CID: 16736764

4992. CHEMBL229943; SCHEMBL1394785; BDBM20807 ...
MW:     367.631580 g/mol MF: C13H12BrClN6
IUPAC name: 9-[(4-bromo-3,5-dimethylpyridin-2-yl)methyl]-6-chloropurin-2...
Create Date: 2007-09-27
CID: 16736532

4993. CHEMBL388347; SCHEMBL3396032; BDBM20805 ...
MW:     353.206560 g/mol MF: C14H14Cl2N6O
IUPAC name: 6-chloro-9-[(6-chloro-4-methoxy-3,5-dimethylpyridin-2-yl)met...
Create Date: 2007-09-27
CID: 16736531

4994. CHEMBL229838; SCHEMBL3396226; BDBM20802 ...
MW:     332.788080 g/mol MF: C15H17ClN6O
IUPAC name: 6-chloro-9-[(4-ethoxy-3,5-dimethylpyridin-2-yl)methyl]purin-...
Create Date: 2007-09-27
CID: 16736530

4995. 848695-25-0; BIIB021; 6-chloro-9-((4-methoxy-3,5-dimethylpyridin-2-yl)methyl)-9H-purin-2-amine ...
MW:     318.761500 g/mol MF: C14H15ClN6O
IUPAC name: 6-chloro-9-[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]purin...
Create Date: 2007-09-27
CID: 16736529

4996. CHEMBL229839; SCHEMBL14438237; BDBM20804 ...
MW:     334.760900 g/mol MF: C14H15ClN6O2
IUPAC name: 6-chloro-9-[(4-methoxy-3,5-dimethyl-1-oxidopyridin-1-ium-2-y...
Create Date: 2007-09-27
CID: 16736528

4997. CHEMBL375462; SCHEMBL1395265; BDBM20801 ...
MW:     304.734920 g/mol MF: C13H13ClN6O
IUPAC name: 2-[(2-amino-6-chloropurin-9-yl)methyl]-3,5-dimethyl-1H-pyrid...
Create Date: 2007-09-27
CID: 16736319

4998. CHEMBL228989; SCHEMBL1394283; BDBM20815 ...
MW:     288.735520 g/mol MF: C13H13ClN6
IUPAC name: 6-chloro-9-[(3,5-dimethylpyridin-2-yl)methyl]purin-2-amine
Create Date: 2007-09-27
CID: 16736116

4999. CHEMBL229797; BDBM20814; 2-amino-6-halopurine analogue, 36 ...
MW:     350.826500 g/mol MF: C14H15ClN6OS
IUPAC name: 6-chloro-9-[(3,5-dimethyl-4-methylsulfinylpyridin-2-yl)methy...
Create Date: 2007-09-27
CID: 16735922

5000. BDBM20811; 2-amino-6-halopurine analogue, 33; 2-[(2-amino-6-chloro-9H-purin-9-yl)methyl]-3,5-dimethylpyridine-4-carbonitrile
MW:     313.744980 g/mol MF: C14H12ClN7
IUPAC name: 2-[(2-amino-6-chloropurin-9-yl)methyl]-3,5-dimethylpyridine-...
Create Date: 2007-09-27
CID: 16735921

5001. CHEMBL228406; SCHEMBL3391525; BDBM20809 ...
MW:     333.733080 g/mol MF: C13H12ClN7O2
IUPAC name: 6-chloro-9-[(3,5-dimethyl-4-nitropyridin-2-yl)methyl]purin-2...
Create Date: 2007-09-27
CID: 16735920

5002. CHEMBL229577; SCHEMBL3392728; BDBM20813 ...
MW:     334.827100 g/mol MF: C14H15ClN6S
IUPAC name: 6-chloro-9-[(3,5-dimethyl-4-methylsulfanylpyridin-2-yl)methy...
Create Date: 2007-09-27
CID: 16735916

5003. CHEMBL229639; SCHEMBL3393012; BDBM20788 ...
MW:     349.772240 g/mol MF: C15H16ClN5O3
IUPAC name: 6-chloro-9-[(3,4,5-trimethoxyphenyl)methyl]purin-2-amine
Create Date: 2007-09-27
CID: 16735062

5004. CHEMBL468781; SCHEMBL3395411; BDBM20799 ...
MW:     318.761500 g/mol MF: C14H15ClN6O
IUPAC name: 6-chloro-9-[(5-methoxy-4,6-dimethylpyridin-3-yl)methyl]purin...
Create Date: 2007-09-27
CID: 16735061

5005. CHEMBL231530; SCHEMBL5748334; BDBM25920 ...
MW:     262.309160 g/mol MF: C16H14N4
Create Date: 2007-08-13
CID: 16663529

5006. CHEMBL235981; BDBM23001; N-arachidonoylserotonin analogue, 1n ...
MW:     468.629740 g/mol MF: C31H36N2O2
IUPAC name: N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-4-[3-(3-pentylphenyl)ph...
Create Date: 2007-06-19
CID: 16117763

5007. CHEMBL235983; BDBM23002; N-arachidonoylserotonin analogue, 1o ...
MW:     442.592460 g/mol MF: C29H34N2O2
IUPAC name: N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-4-(7-pentylnaphthalen-2...
Create Date: 2007-06-19
CID: 16117762

5008. CHEMBL236807; SCHEMBL14542240; BDBM22996 ...
MW:     364.480620 g/mol MF: C23H28N2O2
IUPAC name: N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-7-phenylheptanamide
Create Date: 2007-04-30
CID: 16045350

5009. BDBM9228; CHEMBL407895; isothiazolidine 1,1-dioxide analog ...
MW:     638.815480 g/mol MF: C38H42N2O5S
IUPAC name: (2R,4S)-2-benzyl-5-[(3S,5S)-3,5-dibenzyl-1,1-dioxo-1,2-thiaz...
Create Date: 2007-03-08
CID: 15954109

5010. CHEMBL259298; SCHEMBL2481996; BDBM21608 ...
MW:     428.822480 g/mol MF: C21H17ClN2O6
IUPAC name: 2-[(3S)-5-chloro-1'-[(3-methoxyphenyl)methyl]-2,2',5'-trioxo...
Create Date: 2007-03-07
CID: 15949679

5011. CHEMBL259519; SCHEMBL2484154; BDBM21606 ...
MW:     433.241560 g/mol MF: C20H14Cl2N2O5
IUPAC name: 2-[(3S)-5-chloro-1'-[(3-chlorophenyl)methyl]-2,2',5'-trioxos...
Create Date: 2007-03-07
CID: 15949678

5012. CHEMBL411315; SCHEMBL2483382; BDBM21605 ...
MW:     433.241560 g/mol MF: C20H14Cl2N2O5
IUPAC name: 2-[(3R)-5-chloro-1'-[(3-chlorophenyl)methyl]-2,2',5'-trioxos...
Create Date: 2007-03-07
CID: 15949677

5013. CHEMBL374305; SCHEMBL6786319; BDBM12742 ...
MW:     575.580930 g/mol MF: C31H28F3N5O3
IUPAC name: 3-[6-[4-[2-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]phenyl]phe...
Create Date: 2007-02-08
CID: 12988920

5014. CHEMBL190767; BDBM17753; pentanedioic acid analogue, (R)-2 ...
MW:     390.196558 g/mol MF: C13H12F5O6P
IUPAC name: (2R)-2-[[hydroxy-[(2,3,4,5,6-pentafluorophenyl)methyl]phosph...
Create Date: 2006-10-26
CID: 11773692

5015. CHEMBL227259; SCHEMBL1041410; BDBM20571 ...
MW:     460.551360 g/mol MF: C24H24N6O2S
IUPAC name: N-[4-[6-(4-benzylpiperazin-1-yl)pyrimidin-4-yl]oxy-1,3-benzo...
Create Date: 2006-10-26
CID: 11754004

5016. CHEMBL560151; SCHEMBL4688111; BDBM29815 ...
MW:     546.680360 g/mol MF: C30H34N4O4S
Create Date: 2006-10-26
CID: 11753622

5017. (S)-2-MPPA; CHEMBL370707; SCHEMBL16529159 ...
MW:     206.259360 g/mol MF: C8H14O4S
IUPAC name: (2S)-2-(3-sulfanylpropyl)pentanedioic acid
Create Date: 2006-10-26
CID: 11735892

5018. CHEMBL382847; BDBM11708; (2S)-Cyanopyrrolidine analogue 18l ...
MW:     350.363106 g/mol MF: C17H20F2N4O2
IUPAC name: 3-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl]amino]-N-[(3,...
Create Date: 2006-10-26
CID: 11717268

5019. CHEMBL200103; SCHEMBL3555830; BDBM11697 ...
MW:     340.419460 g/mol MF: C19H24N4O2
IUPAC name: (2S)-1-[2-[[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]...
Create Date: 2006-10-26
CID: 11717090

5020. CHEMBL201753; SCHEMBL3552004; BDBM11702 ...
MW:     490.575800 g/mol MF: C22H30N6O5S
IUPAC name: N-[4-[4-[3-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl]amin...
Create Date: 2006-10-26
CID: 11705859

5021. CHEMBL383841; SCHEMBL13444780; BDBM11704 ...
MW:     426.535140 g/mol MF: C21H26N6O2S
IUPAC name: (2S)-1-[2-[[3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-3-ox...
Create Date: 2006-10-26
CID: 11704578

5022. CHEMBL372391; BDBM11709; (2S)-Cyanopyrrolidine analogue 18m ...
MW:     356.461920 g/mol MF: C20H28N4O2
IUPAC name: 3-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl]amino]-N-(2-m...
Create Date: 2006-10-26
CID: 11703158

5023. CHEMBL201158; SCHEMBL3546283; BDBM11710 ...
MW:     342.435340 g/mol MF: C19H26N4O2
IUPAC name: 3-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl]amino]-N-(2-p...
Create Date: 2006-10-26
CID: 11702902

5024. CHEMBL371907; BDBM11696; (2S)-Cyanopyrrolidine analogue 17 ...
MW:     326.392880 g/mol MF: C18H22N4O2
IUPAC name: (2S)-1-[2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]a...
Create Date: 2006-10-26
CID: 11695535

5025. CHEMBL424854; BDBM11698; (2S)-Cyanopyrrolidine analogue 18b ...
MW:     400.471420 g/mol MF: C21H28N4O4
IUPAC name: (2S)-1-[2-[[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl...
Create Date: 2006-10-26
CID: 11689866

5026. CHEMBL371480; BDBM11712; (2S)-Cyanopyrrolidine analogue 18p ...
MW:     300.355600 g/mol MF: C16H20N4O2
IUPAC name: 3-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl]amino]-N-phen...
Create Date: 2006-10-26
CID: 11680991

5027. CHEMBL382907; SCHEMBL3556999; BDBM11705 ...
MW:     314.382180 g/mol MF: C17H22N4O2
IUPAC name: N-benzyl-3-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl]amin...
Create Date: 2006-10-26
CID: 11645337

5028. CHEMBL202711; BDBM11720; (2S)-Cyanopyrrolidine analogue 21e ...
MW:     370.488500 g/mol MF: C21H30N4O2
IUPAC name: 3-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl]amino]-3-meth...
Create Date: 2006-10-26
CID: 11624893

5029. CHEMBL425585; BDBM11714; (2S)-Cyanopyrrolidine analogue 20a ...
MW:     354.446040 g/mol MF: C20H26N4O2
IUPAC name: (2S)-1-[2-[[(2S)-4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobu...
Create Date: 2006-10-26
CID: 11617338

5030. CHEMBL372746; SCHEMBL3554462; BDBM11701 ...
MW:     433.451706 g/mol MF: C21H25F2N5O3
IUPAC name: (2S)-1-[2-[[3-[4-(3,5-difluorobenzoyl)piperazin-1-yl]-3-oxop...
Create Date: 2006-10-26
CID: 11604454

5031. CHEMBL201424; SCHEMBL1064193; BDBM11716 ...
MW:     368.472620 g/mol MF: C21H28N4O2
IUPAC name: (2S)-1-[2-[[4-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-4-o...
Create Date: 2006-10-26
CID: 11581458

5032. CHEMBL203084; BDBM11699; (2S)-Cyanopyrrolidine analogue 18c ...
MW:     358.409923 g/mol MF: C19H23FN4O2
IUPAC name: (2S)-1-[2-[[3-(6-fluoro-3,4-dihydro-1H-isoquinolin-2-yl)-3-o...
Create Date: 2006-10-26
CID: 11581247

5033. CHEMBL201695; SCHEMBL3554544; BDBM11707 ...
MW:     342.435340 g/mol MF: C19H26N4O2
IUPAC name: 3-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl]amino]-N-(1-p...
Create Date: 2006-10-26
CID: 11580945

5034. CHEMBL203032; SCHEMBL3549343; BDBM11706 ...
MW:     359.379740 g/mol MF: C17H21N5O4
IUPAC name: 3-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl]amino]-N-[(4-...
Create Date: 2006-10-26
CID: 11574031

5035. CHEMBL381530; BDBM11700; (2S)-Cyanopyrrolidine analogue 18d ...
MW:     326.392880 g/mol MF: C18H22N4O2
IUPAC name: (2S)-1-[2-[[3-(1,3-dihydroisoindol-2-yl)-3-oxopropyl]amino]a...
Create Date: 2006-10-26
CID: 11573417

5036. CHEMBL201544; SCHEMBL3551018; BDBM11711 ...
MW:     328.408760 g/mol MF: C18H24N4O2
IUPAC name: 3-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl]amino]-N-(2-p...
Create Date: 2006-10-26
CID: 11566106

5037. CHEMBL380902; BDBM11717; (2S)-Cyanopyrrolidine analogue 21b ...
MW:     386.463083 g/mol MF: C21H27FN4O2
IUPAC name: (2S)-1-[2-[[4-(6-fluoro-3,4-dihydro-1H-isoquinolin-2-yl)-2-m...
Create Date: 2006-10-26
CID: 11545508

5038. 895155-57-4; (1-((Tetrahydro-2H-pyran-4-yl)methyl)-1H-indol-3-yl)(2,2,3,3-tetramethylcyclopropyl)methanone; UNII-XE27L67C93 ...
MW:     339.471160 g/mol MF: C22H29NO2
IUPAC name: [1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3-tetramethylcyclopro...
Create Date: 2006-10-26
CID: 11544639

5039. CHEMBL425756; BDBM11718; (2S)-Cyanopyrrolidine analogue 21c ...
MW:     404.453546 g/mol MF: C21H26F2N4O2
IUPAC name: (2S)-1-[2-[[4-(6,8-difluoro-3,4-dihydro-1H-isoquinolin-2-yl)...
Create Date: 2006-10-26
CID: 11538673

5040. CHEMBL371057; BDBM11713; (2S)-Cyanopyrrolidine analogue 19 ...
MW:     354.446040 g/mol MF: C20H26N4O2
IUPAC name: (2S)-1-[2-[[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobutyl]a...
Create Date: 2006-10-26
CID: 11515912

5041. CHEMBL201398; BDBM11715; (2S)-Cyanopyrrolidine analogue 20b ...
MW:     382.499200 g/mol MF: C22H30N4O2
IUPAC name: (2S)-1-[2-[[(3R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methy...
Create Date: 2006-10-26
CID: 11494684

5042. CHEMBL549458; SCHEMBL4692654; BDBM29802 ...
MW:     498.637560 g/mol MF: C26H34N4O4S
Create Date: 2006-10-26
CID: 11478322

5043. CHEMBL227316; SCHEMBL13897552; BDBM20577 ...
MW:     492.568403 g/mol MF: C25H25FN6O2S
IUPAC name: N-[4-[6-[4-[1-(2-fluorophenyl)ethyl]piperazin-1-yl]pyrimidin...
Create Date: 2006-10-26
CID: 11477418

5044. CHEMBL558273; SCHEMBL4689602; BDBM29809 ...
MW:     512.664140 g/mol MF: C27H36N4O4S
Create Date: 2006-10-26
CID: 11443660

5045. CHEMBL389164; SCHEMBL3393864; BDBM20808 ...
MW:     414.632050 g/mol MF: C13H12ClIN6
IUPAC name: 6-chloro-9-[(4-iodo-3,5-dimethylpyridin-2-yl)methyl]purin-2-...
Create Date: 2006-10-26
CID: 11407335

5046. CHEMBL191591; BDBM17754; pentanedioic acid analogue, (S)-2 ...
MW:     390.196558 g/mol MF: C13H12F5O6P
IUPAC name: (2S)-2-[[hydroxy-[(2,3,4,5,6-pentafluorophenyl)methyl]phosph...
Create Date: 2006-10-26
CID: 11361279

5047. CHEMBL563114; SCHEMBL4692644; BDBM29813 ...
MW:     602.616456 g/mol MF: C27H31F5N4O4S
Create Date: 2006-10-26
CID: 11354252

5048. CHEMBL226572; SCHEMBL13897811; BDBM20579 ...
MW:     542.575910 g/mol MF: C26H25F3N6O2S
IUPAC name: N-[4-[6-[4-[1-[4-(trifluoromethyl)phenyl]ethyl]piperazin-1-y...
Create Date: 2006-10-26
CID: 11353246

5049. AMG-628; UNII-G8JW58493W; N-{4-[(6-{4-[(1R)-1-(4-fluorophenyl)ethyl]piperazin-1-yl}pyrimidin-4-yl)oxy]-1,3-benzothiazol-2-yl}acetamide ...
MW:     492.568403 g/mol MF: C25H25FN6O2S
IUPAC name: N-[4-[6-[4-[(1R)-1-(4-fluorophenyl)ethyl]piperazin-1-yl]pyri...
Create Date: 2006-10-26
CID: 11352366

5050. CHEMBL189901; BDBM16048; truncated OM99-2 acyclic analog 2 ...
MW:     616.704220 g/mol MF: C27H48N6O10
IUPAC name: (4S)-4-amino-5-[[(2S)-1-[[(2S)-4-amino-1-[[(4S,5S,7R)-8-[[(1...
Create Date: 2006-10-26
CID: 11330997

5051. CHEMBL556660; SCHEMBL5930527; BDBM29799 ...
MW:     526.690720 g/mol MF: C28H38N4O4S
Create Date: 2006-10-26
CID: 11329962

5052. AMG 628; CHEMBL387512; SCHEMBL4108728 ...
MW:     492.568403 g/mol MF: C25H25FN6O2S
IUPAC name: N-[4-[6-[4-[1-(4-fluorophenyl)ethyl]piperazin-1-yl]pyrimidin...
Create Date: 2006-10-26
CID: 11329359

5053. CHEMBL540757; SCHEMBL4695053; BDBM29812 ...
MW:     534.618486 g/mol MF: C26H32F2N4O4S
Create Date: 2006-10-26
CID: 11318606

5054. UNII-16W72ZO379; CHEMBL390934; SCHEMBL3881489 ...
MW:     492.568403 g/mol MF: C25H25FN6O2S
IUPAC name: N-[4-[6-[4-[(1S)-1-(4-fluorophenyl)ethyl]piperazin-1-yl]pyri...
Create Date: 2006-10-26
CID: 11317868

5055. (R)-2-MPPA; CHEMBL190285; BDBM17756 ...
MW:     206.259360 g/mol MF: C8H14O4S
IUPAC name: (2R)-2-(3-sulfanylpropyl)pentanedioic acid
Create Date: 2006-10-26
CID: 11310264

5056. CHEMBL534410; SCHEMBL5930127; BDBM29803 ...
MW:     498.637560 g/mol MF: C26H34N4O4S
Create Date: 2006-10-26
CID: 11295726

5057. CHEMBL554281; SCHEMBL4688964; BDBM29800 ...
MW:     508.632380 g/mol MF: C27H32N4O4S
Create Date: 2006-10-26
CID: 11295146

5058. CHEMBL229691; SCHEMBL3396045; BDBM20792 ...
MW:     473.119300 g/mol MF: C15H15Br2N5O3
IUPAC name: 6-bromo-9-[(2-bromo-3,4,5-trimethoxyphenyl)methyl]purin-2-am...
Create Date: 2006-10-26
CID: 11294416

5059. CHEMBL562703; SCHEMBL5930062; BDBM29810 ...
MW:     516.628023 g/mol MF: C26H33FN4O4S
Create Date: 2006-10-26
CID: 11284421

5060. CHEMBL562487; SCHEMBL4689870; BDBM29811 ...
MW:     516.628023 g/mol MF: C26H33FN4O4S
Create Date: 2006-10-26
CID: 11238352

5061. CHEMBL550208; SCHEMBL4688823; BDBM29804 ...
MW:     510.648260 g/mol MF: C27H34N4O4S
Create Date: 2006-10-26
CID: 11238286

5062. CHEMBL227317; SCHEMBL13897946; BDBM20578 ...
MW:     492.568403 g/mol MF: C25H25FN6O2S
IUPAC name: N-[4-[6-[4-[1-(3-fluorophenyl)ethyl]piperazin-1-yl]pyrimidin...
Create Date: 2006-10-26
CID: 11202687

5063. CHEMBL540758; SCHEMBL4693119; BDBM29814 ...
MW:     552.608950 g/mol MF: C26H31F3N4O4S
Create Date: 2006-10-26
CID: 11180403

5064. CHEMBL226573; SCHEMBL13897893; BDBM20580 ...
MW:     504.603920 g/mol MF: C26H28N6O3S
IUPAC name: N-[4-[6-[4-[1-(4-methoxyphenyl)ethyl]piperazin-1-yl]pyrimidi...
Create Date: 2006-10-26
CID: 11179647

5065. CHEMBL562290; SCHEMBL5930171; BDBM29801 ...
MW:     508.632380 g/mol MF: C27H32N4O4S
Create Date: 2006-10-26
CID: 11168125

5066. (S)-2-(Phosphonomethyl)Pentanedioic Acid; (2s)-2-(Phosphonomethyl)pentanedioic Acid; G88 ...
MW:     226.121102 g/mol MF: C6H11O7P
IUPAC name: (2S)-2-(phosphonomethyl)pentanedioic acid
Create Date: 2006-10-26
CID: 11085481

5067. (R)-2-(Phosphonomethyl)Pentanedioic Acid; (R)-2-PMPA; CHEMBL191467 ...
MW:     226.121102 g/mol MF: C6H11O7P
IUPAC name: (2R)-2-(phosphonomethyl)pentanedioic acid
Create Date: 2006-10-26
CID: 11031538

5068. CHEMBL227179; BDBM22398; WIN 35,065-2 Analogue, 4a ...
MW:     394.960120 g/mol MF: C23H23ClN2S
IUPAC name: 2-[(1S,3S,4S,5R)-3-(4-chlorophenyl)-8-methyl-8-azabicyclo[3....
Create Date: 2006-10-25
CID: 10524711

5069. (2S)-cyanopyrrolidine 4; CHEMBL201644; SCHEMBL1069325 ...
MW:     354.446040 g/mol MF: C20H26N4O2
IUPAC name: (2S)-1-[2-[[4-(1,3-dihydroisoindol-2-yl)-2-methyl-4-oxobutan...
Create Date: 2006-10-25
CID: 10383508

5070. CHEMBL381328; SCHEMBL6849719; BDBM15084 ...
MW:     381.469620 g/mol MF: C25H23N3O
IUPAC name: (2S)-1-naphthalen-2-yl-3-[5-[(E)-2-pyridin-4-ylethenyl]pyrid...
Create Date: 2006-10-25
CID: 10309398

5071. CHEMBL206236; SCHEMBL6833730; BDBM15079 ...
MW:     361.436920 g/mol MF: C22H23N3O2
IUPAC name: (2S)-1-phenylmethoxy-3-[5-[(E)-2-pyridin-4-ylethenyl]pyridin...
Create Date: 2006-10-25
CID: 10309109

5072. CHEMBL203434; SCHEMBL6855881; BDBM15077 ...
MW:     407.506900 g/mol MF: C27H25N3O
IUPAC name: (2S)-1,1-diphenyl-3-[5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-...
Create Date: 2006-10-25
CID: 10287639

5073. CHEMBL206183; SCHEMBL6854536; BDBM15085 ...
MW:     387.497340 g/mol MF: C23H21N3OS
IUPAC name: (2S)-1-(1-benzothiophen-3-yl)-3-[5-[(E)-2-pyridin-4-yletheny...
Create Date: 2006-10-25
CID: 10287346

5074. CHEMBL206198; SCHEMBL6853603; BDBM15089 ...
MW:     404.892040 g/mol MF: C23H21ClN4O
IUPAC name: (2S)-1-[2-chloro-5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl]o...
Create Date: 2006-10-25
CID: 10237750

5075. CHEMBL203329; SCHEMBL6853573; BDBM15094 ...
MW:     402.919220 g/mol MF: C24H23ClN4
IUPAC name: (2R)-4-[6-chloro-5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl]-...
Create Date: 2006-10-25
CID: 10237709

5076. CHEMBL218525; SCHEMBL6785555; BDBM12740 ...
MW:     520.545490 g/mol MF: C29H27F3N4O2
IUPAC name: 6-[4-[2-[(dimethylamino)methyl]phenyl]phenyl]-1-(4-methoxyph...
Create Date: 2006-10-25
CID: 10208201

5077. 2-(3-mercaptopropyl)pentanedioic acid; 2-(3-sulfanylpropyl)pentanedioic Acid; CHEMBL303352 ...
MW:     206.259360 g/mol MF: C8H14O4S
IUPAC name: 2-(3-sulfanylpropyl)pentanedioic acid
Create Date: 2006-10-25
CID: 10198171

5078. CHEMBL379914; SCHEMBL6851153; BDBM15088 ...
MW:     404.892040 g/mol MF: C23H21ClN4O
IUPAC name: (2S)-1-[6-chloro-5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl]o...
Create Date: 2006-10-25
CID: 10194362

5079. CHEMBL380958; SCHEMBL6857911; BDBM15092 ...
MW:     371.431740 g/mol MF: C23H21N3O2
IUPAC name: 1-(1H-indol-3-yl)-3-[5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-...
Create Date: 2006-10-25
CID: 10172543

5080. CHEMBL381808; SCHEMBL6855442; BDBM15087 ...
MW:     370.446980 g/mol MF: C23H22N4O
IUPAC name: (2R)-1-(1H-indol-3-yl)-3-[5-[(E)-2-pyridin-4-ylethenyl]pyrid...
Create Date: 2006-10-25
CID: 10150362

5081. 2-(phosphonomethyl)pentanedioic acid; 173039-10-6; 2-PMPA ...
MW:     226.121102 g/mol MF: C6H11O7P
IUPAC name: 2-(phosphonomethyl)pentanedioic acid
Create Date: 2006-10-25
CID: 10130754

5082. CHEMBL206328; SCHEMBL6833622; SCHEMBL6833624 ...
MW:     436.344280 g/mol MF: C23H22BrN3O
IUPAC name: (E)-3-(4-bromophenyl)-N-[2-[5-[(E)-2-pyridin-4-ylethenyl]pyr...
Create Date: 2006-10-25
CID: 10127292

5083. CHEMBL230185; SCHEMBL5076827; BDBM25923 ...
MW:     359.467400 g/mol MF: C22H25N5
Create Date: 2006-10-25
CID: 10109125

5084. CHEMBL227210; SCHEMBL1042241; BDBM20570 ...
MW:     446.524780 g/mol MF: C23H22N6O2S
IUPAC name: N-[4-[6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]oxy-1,3-benzo...
Create Date: 2006-10-25
CID: 10095108

5085. CHEMBL419932; bispyridinylethylene, 1; BDBM15069 ...
MW:     289.760040 g/mol MF: C15H16ClN3O
IUPAC name: (2S)-1-[6-chloro-5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl]o...
Create Date: 2006-10-25
CID: 10062782

5086. CHEMBL230184; SCHEMBL5137193; BDBM25922 ...
MW:     292.335140 g/mol MF: C17H16N4O
Create Date: 2006-10-25
CID: 9922100

5087. CHEMBL64901; SCHEMBL4543745; BDBM17752 ...
MW:     390.196558 g/mol MF: C13H12F5O6P
IUPAC name: 2-[[hydroxy-[(2,3,4,5,6-pentafluorophenyl)methyl]phosphoryl]...
Create Date: 2006-10-25
CID: 9800545

5088. CHEMBL249899; SCHEMBL4984117; BDBM25921 ...
MW:     305.376960 g/mol MF: C18H19N5
Create Date: 2006-10-25
CID: 9796523

5089. Lucifer Yellow CH biphenylbis analog; 2'-2'-[(1,1'Biphenyl-4',4-diyl)bis[(hydrazonocarbonyl)amino]-6-amino-1,3-dioxo-1H-benzo[de]isoquinoline-5,8-disulfonic acid; 6-amino-2-[[(E)-[4-[4-[(E)-[(6-amino-1,3-dioxo-5,8-disulfo-benzo[de]isoquinolin-2-yl)carbamoylhydrazono]methyl]phenyl]phenyl]methyleneamino]carbamoylamino]-1,3-dioxo-benzo[de]isoquinoline-5,8-disulfonic acid
MW:    1064.966520 g/mol MF: C40H28N10O18S4
IUPAC name: 6-amino-2-[[(E)-[4-[4-[(E)-[(6-amino-1,3-dioxo-5,8-disulfobe...
Create Date: 2006-10-24
CID: 9574190

5090. CHEMBL222079; SCHEMBL5819494; BDBM12733 ...
MW:     533.544250 g/mol MF: C29H26F3N5O2
IUPAC name: 3-[6-[4-[2-[(dimethylamino)methyl]phenyl]phenyl]-7-oxo-3-(tr...
Create Date: 2006-10-13
CID: 9549214

5091. (1S)-2-(1H-INDOL-3-YL)-1-[({5-[(E)-2-PYRIDIN-4-YLVINYL]PYRIDIN-3-YL}OXY)METHYL]ETHYLAMINE; 4EA; 3-[(2S)-2-amino-3-({5-[(E)-2-(pyridin-4-yl)ethenyl]pyridin-3-yl}oxy)propyl]-1H-indole ...
MW:     370.446980 g/mol MF: C23H22N4O
IUPAC name: (2S)-1-(1H-indol-3-yl)-3-[5-[(E)-2-pyridin-4-ylethenyl]pyrid...
Create Date: 2006-07-13
CID: 6914613

5092. AC1NU9PY; SCHEMBL931416; SCHEMBL8930945 ...
MW:     285.321040 g/mol MF: C14H11N3O2S
IUPAC name: (4Z)-3-hydroxy-4-(4-phenyl-5-sulfanylidene-1,2,4-triazolidin...
Create Date: 2005-07-09
CID: 5422307

5093. AC1NS5GD; BDBM4423; cyclic sulfamide, biaryl analog 10 ...
MW:     566.709760 g/mol MF: C34H34N2O4S
IUPAC name: (4S,5S)-1,1-dioxo-2,7-bis[[2-[(E)-2-phenylethenyl]phenyl]met...
Create Date: 2006-01-30
CID: 5328836

5094. (4S,5S)-2,7-bis[(2-benzylphenyl)methyl]-1,1-dioxo-1,2,7-thiadiazepane-4,5-diol; AC1MHYN0; BDBM4425 ...
MW:     542.688360 g/mol MF: C32H34N2O4S
IUPAC name: (4S,5S)-2,7-bis[(2-benzylphenyl)methyl]-1,1-dioxo-1,2,7-thia...
Create Date: 2005-08-01
CID: 3013776

5095. (4S,5S)-1,1-dioxo-2,7-bis[(2-phenethylphenyl)methyl]-1,2,7-thiadiazepane-4,5-diol; AC1MHYMX; BDBM4424 ...
MW:     570.741520 g/mol MF: C34H38N2O4S
IUPAC name: (4S,5S)-1,1-dioxo-2,7-bis[[2-(2-phenylethyl)phenyl]methyl]-1...
Create Date: 2005-08-01
CID: 3013775

5096. ST50011467; SMR000070041; AC1MER3S ...
MW:     256.318040 g/mol MF: C12H16O4S
IUPAC name: 2-methyl-5-(oxolan-2-ylmethylsulfanylmethyl)furan-3-carboxyl...
Create Date: 2005-07-28
CID: 2859804

5097. BAS 04848184; AC1LYK6V; MLS001211987 ...
MW:     370.440520 g/mol MF: C16H18O6S2
IUPAC name: 5-[2-[(4-carboxy-5-methylfuran-2-yl)methylsulfanyl]ethylsulf...
Create Date: 2005-07-13
CID: 1901514

5098. 3-[(3,4-dimethylphenoxy)methyl]furan-2-carboxylic acid; 3-[(3,4-Dimethylphenoxy)methyl]-2-furoic acid; SMR000070598 ...
MW:     246.258560 g/mol MF: C14H14O4
IUPAC name: 3-[(3,4-dimethylphenoxy)methyl]furan-2-carboxylic acid
Create Date: 2005-03-27
CID: 580604

5099. CHEMBL327599; AC1LA6S7; SCHEMBL7296464 ...
MW:     615.762300 g/mol MF: C35H45N5O5
IUPAC name: (2S)-N-[(2S,3R)-4-[(1S,2R)-2-(tert-butylcarbamoyl)cyclohexyl...
Create Date: 2005-08-01
CID: 462759

5100. Sulfone deriv. 21; AC1L9SYK; CHEMBL17571 ...
MW:     549.722520 g/mol MF: C28H43N3O6S
IUPAC name: (1,1-dioxothietan-3-yl) N-[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-b...
Create Date: 2005-08-01
CID: 455501

5101. Sulfone deriv. 15; AC1L9SY2; CHEMBL405657 ...
MW:     501.658120 g/mol MF: C28H43N3O5
IUPAC name: [(3S)-oxolan-3-yl] N-[(2S,3R)-4-[(3S,4aS,7aS)-3-(tert-butylc...
Create Date: 2005-08-01
CID: 455495

5102. AC1L9RUJ; CHEMBL17704; IsoquinCON MeSO2Et urethane analog ...
MW:     551.738400 g/mol MF: C28H45N3O6S
IUPAC name: 2-methylsulfonylethyl N-[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-but...
Create Date: 2005-08-01
CID: 454759

5103. CHEMBL82338; 142580-65-2; 3(3(S)-(((1,1-Dimethylethoxy)carbonyl)amino)-4-phenyl-2(R)-hydroxybutyl)-N-(1,1-dimethylethyl)-3-decahydroisoquinolinecarboxamide ...
MW:     501.701180 g/mol MF: C29H47N3O4
IUPAC name: tert-butyl N-[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl...
Create Date: 2005-08-01
CID: 454282

5104. 1-{(1R,2S)-2-HYDROXY-1-[2-(2-NAPHTHYLOXY)ETHYL]PROPYL}-1H-IMIDAZONE-4-CARBOXAMIDE; 1v7a; AC1L9MM9 ...
MW:     339.388340 g/mol MF: C19H21N3O3
IUPAC name: 1-[(3R,4S)-4-hydroxy-1-naphthalen-2-yloxypentan-3-yl]imidazo...
Create Date: 2005-06-24
CID: 449015

5105. CHEMBL328139; 1-[(3R,4S)-1-(2,3-dichlorophenyl)-4-hydroxypentan-3-yl]imidazole-4-carboxamide; AC1L9MM7 ...
MW:     342.220380 g/mol MF: C15H17Cl2N3O2
IUPAC name: 1-[(3R,4S)-1-(2,3-dichlorophenyl)-4-hydroxypentan-3-yl]imida...
Create Date: 2005-06-24
CID: 449014

5106. CHEMBL93560; UNII-10302WQ21V; FR233623 ...
MW:     323.388940 g/mol MF: C19H21N3O2
IUPAC name: 1-[(3R,4S)-4-hydroxy-1-naphthalen-1-ylpentan-3-yl]imidazole-...
Create Date: 2005-06-24
CID: 449013

5107. NSC291094; AC1L8ARW; STREPTONIGRIN ANALOG (ETNH) ...
MW:     202.209300 g/mol MF: C11H10N2O2
IUPAC name: 6-(ethylamino)quinoline-5,8-dione
Create Date: 2005-03-26
CID: 324770

5108. CCRIS 7254; cis-1,1'-(3,3-Dichloro-1,2-cyclopropanediyl)bis(benzene); 1,1'-[(1r,2s)-3,3-dichlorocyclopropane-1,2-diyl]dibenzene ...
MW:     263.161780 g/mol MF: C15H12Cl2
IUPAC name: [(1R,3S)-2,2-dichloro-3-phenylcyclopropyl]benzene
Create Date: 2005-08-08
CID: 161914

5109. Trichloronate oxon; ethyl-2,4,5-trichlorphenyl-ethylphosphonat; Trichloronate-oxon ...
MW:     317.533242 g/mol MF: C10H12Cl3O3P
IUPAC name: 1,2,4-trichloro-5-[ethoxy(ethyl)phosphoryl]oxybenzene
Create Date: 2005-08-08
CID: 160846

5110. UNII-77TK99424J; 77TK99424J; CHM-081 ...
MW:     397.508780 g/mol MF: C27H27NO2
IUPAC name: [1-(cyclohexylmethyl)indol-3-yl]-(4-methoxynaphthalen-1-yl)m...
Create Date: 2016-03-16
CID: 118796420

5111. UNII-22GGZ1S2LF; 22GGZ1S2LF; JWH-122 N-(5-chloropentyl) analog ...
MW:     389.917160 g/mol MF: C25H24ClNO
IUPAC name: [1-(5-chloropentyl)indol-3-yl]-(4-methylnaphthalen-1-yl)meth...
Create Date: 2015-09-11
CID: 91864523

5112. FUTZNJGWIOVOHS-UHFFFAOYSA-N; Fentanyl, 4-N-(5-hexenyl) analogue
MW:     314.465000 g/mol MF: C20H30N2O
IUPAC name: N-(1-hex-5-enylpiperidin-4-yl)-N-phenylpropanamide
Create Date: 2015-04-28
CID: 91753687

5113. CFTLBFPBPVNYCA-UHFFFAOYSA-N; Fentanyl, 4-N-(4-pentenyl) analogue
MW:     300.438420 g/mol MF: C19H28N2O
IUPAC name: N-(1-pent-4-enylpiperidin-4-yl)-N-phenylpropanamide
Create Date: 2015-04-28
CID: 91753685

5114. KKAQHFNNAZOJDZ-UHFFFAOYSA-N; Fentanyl, 4-N-(3-butenyl) analogue
MW:     286.411840 g/mol MF: C18H26N2O
IUPAC name: N-(1-but-3-enylpiperidin-4-yl)-N-phenylpropanamide
Create Date: 2015-04-28
CID: 91753683

5115. QDWNXDILPHVKLY-UHFFFAOYSA-N; ZINC95215360; JWH 018 N-(5-bromopentyl) analog
MW:     420.341580 g/mol MF: C24H22BrNO
IUPAC name: [1-(5-bromopentyl)indol-3-yl]-naphthalen-1-ylmethanone
Create Date: 2015-04-28
CID: 91740913

5116. Mycobactin-analog-artemisinin conjugate; (4S)-N-[(1S)-5-[Heptadecanoyl(hydroxy)amino]-1-[[(2S)-3-[[(3S)-1-hydroxy-2-oxo-azepan-3-yl]amino]-3-oxo-2-[4-(trimethyl[?]yl)oxybutanoylamino]propyl]carbamoyl]pentyl]-2-(2-hydroxyphenyl)-4,5-dihydrooxazole-4-carboxamide
MW:    1168.460780 g/mol MF: C61H97N7O15
Create Date: 2013-07-09
CID: 71590757

5117. BDBM86771; Nicotinamide hydrochloride analog, 6d
MW:     473.652860 g/mol MF: C29H39N5O
IUPAC name: 4-hydrazinyl-N-[9-(1,2,3,4-tetrahydroacridin-9-ylamino)nonyl...
Create Date: 2012-07-07
CID: 57340727

5118. BDBM86770; Nicotinamide hydrochloride analog, 6c
MW:     446.587760 g/mol MF: C26H34N6O
IUPAC name: 6-hydrazinyl-N-[7-(1,2,3,4-tetrahydroacridin-9-ylamino)hepty...
Create Date: 2012-07-07
CID: 57340725

5119. BDBM86769; Nicotinamide hydrochloride analog, 6b
MW:     418.534600 g/mol MF: C24H30N6O
IUPAC name: 6-hydrazinyl-N-[5-(1,2,3,4-tetrahydroacridin-9-ylamino)penty...
Create Date: 2012-07-07
CID: 57340723

5120. BDBM86768; Nicotinamide hydrochloride analog, 6a
MW:     404.508020 g/mol MF: C23H28N6O
IUPAC name: 6-hydrazinyl-N-[4-(1,2,3,4-tetrahydroacridin-9-ylamino)butyl...
Create Date: 2012-07-07
CID: 57340721

5121. BDBM35885; flufenamic acid tricyclic analogue, 9
MW:     307.224130 g/mol MF: C15H8F3NO3
IUPAC name: 9-oxo-1-(trifluoromethyl)-10H-acridine-4-carboxylic acid
Create Date: 2010-01-04
CID: 44520993

5122. GTPL7994; CHEMBL1160330; analog 3 [Vlattas et al., 1996] ...
MW:     293.105544 g/mol MF: C5H13NO9P2
IUPAC name: 2-[2-[hydroxy(phosphonooxy)phosphoryl]oxyethyl-methylamino]a...
Create Date: 2009-11-19
CID: 44306132

5123. GSK1030062A; CHEMBL482326; BDBM28205 ...
MW:     505.509390 g/mol MF: C24H22F3N3O4S
IUPAC name: 5-(5,6-dimethoxybenzimidazol-1-yl)-N,N-dimethyl-3-[[2-(trifl...
Create Date: 2009-05-20
CID: 25263116

5124. GSK1030061A; CHEMBL518968; BDBM28204 ...
MW:     491.482810 g/mol MF: C23H20F3N3O4S
IUPAC name: 5-(5,6-dimethoxybenzimidazol-1-yl)-N-methyl-3-[[2-(trifluoro...
Create Date: 2009-05-20
CID: 25263115

5125. GSK1030059A; CHEMBL471789; BDBM28203 ...
MW:     476.468170 g/mol MF: C23H19F3N2O4S
IUPAC name: 1-[5-(5,6-dimethoxybenzimidazol-1-yl)-3-[[2-(trifluoromethyl...
Create Date: 2009-05-20
CID: 25263114

5126. CHEMBL482151; SCHEMBL5062372; BDBM28202 ...
MW:     493.521830 g/mol MF: C22H18F3N3O3S2
IUPAC name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-[[2-(trifluoromethyl)ph...
Create Date: 2009-05-20
CID: 25263113

5127. CHEMBL520284; SCHEMBL5062072; BDBM28201 ...
MW:     502.468990 g/mol MF: C22H17F3N6O3S
IUPAC name: 5,6-dimethoxy-1-[5-(2H-tetrazol-5-yl)-4-[[2-(trifluoromethyl...
Create Date: 2009-05-20
CID: 25263112

5128. Kinome_3461; CHEMBL474432; SCHEMBL5058278 ...
MW:     478.440990 g/mol MF: C22H17F3N2O5S
IUPAC name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-[[2-(trifluoromethyl)ph...
Create Date: 2009-05-20
CID: 25263111

5129. GSK1030058A; CHEMBL473420; SCHEMBL5058261 ...
MW:     492.467570 g/mol MF: C23H19F3N2O5S
IUPAC name: methyl 5-(5,6-dimethoxybenzimidazol-1-yl)-3-[[2-(trifluorome...
Create Date: 2009-05-20
CID: 25263110

5130. CHEMBL475763; BDBM28198; benzimidazole thiophene analogue, 50 ...
MW:     489.342380 g/mol MF: C20H17BrN4O4S
IUPAC name: 3-[(2-bromopyridin-4-yl)methoxy]-5-(5,6-dimethoxybenzimidazo...
Create Date: 2009-05-20
CID: 25263109

5131. CHEMBL475762; BDBM28197; benzimidazole thiophene analogue, 49 ...
MW:     410.446320 g/mol MF: C20H18N4O4S
IUPAC name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-(pyridin-4-ylmethoxy)th...
Create Date: 2009-05-20
CID: 25263108

5132. CHEMBL519286; BDBM28196; benzimidazole thiophene analogue, 48 ...
MW:     399.420380 g/mol MF: C19H17N3O5S
IUPAC name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-(furan-3-ylmethoxy)thio...
Create Date: 2009-05-20
CID: 25263107

5133. CHEMBL482349; BDBM28195; benzimidazole thiophene analogue, 47 ...
MW:     399.420380 g/mol MF: C19H17N3O5S
IUPAC name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-(furan-2-ylmethoxy)thio...
Create Date: 2009-05-20
CID: 25263106

5134. CHEMBL480545; BDBM28194; benzimidazole thiophene analogue, 46 ...
MW:     449.931040 g/mol MF: C19H16ClN3O4S2
IUPAC name: 3-[(3-chlorothiophen-2-yl)methoxy]-5-(5,6-dimethoxybenzimida...
Create Date: 2009-05-20
CID: 25263105

5135. CHEMBL480383; SCHEMBL4034949; BDBM28193 ...
MW:     415.485980 g/mol MF: C19H17N3O4S2
IUPAC name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-(thiophen-3-ylmethoxy)t...
Create Date: 2009-05-20
CID: 25263104

5136. GSK312948A; CHEMBL480382; SCHEMBL4037298 ...
MW:     415.485980 g/mol MF: C19H17N3O4S2
IUPAC name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-(thiophen-2-ylmethoxy)t...
Create Date: 2009-05-20
CID: 25263103

5137. CHEMBL520080; SCHEMBL4035220; BDBM28191 ...
MW:     415.505900 g/mol MF: C21H25N3O4S
IUPAC name: 3-(cyclohexylmethoxy)-5-(5,6-dimethoxybenzimidazol-1-yl)thio...
Create Date: 2009-05-20
CID: 25263102

5138. CHEMBL473630; BDBM28190; benzimidazole thiophene analogue, 42 ...
MW:     401.479320 g/mol MF: C20H23N3O4S
IUPAC name: 3-(cyclopentylmethoxy)-5-(5,6-dimethoxybenzimidazol-1-yl)thi...
Create Date: 2009-05-20
CID: 25263101

5139. CHEMBL516362; SCHEMBL5062103; BDBM28189 ...
MW:     437.511420 g/mol MF: C23H23N3O4S
IUPAC name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-(3-phenylpropoxy)thioph...
Create Date: 2009-05-20
CID: 25263100

5140. GSK204925A; CHEMBL473629; SCHEMBL4367870 ...
MW:     423.484840 g/mol MF: C22H21N3O4S
IUPAC name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-(2-phenylethoxy)thiophe...
Create Date: 2009-05-20
CID: 25263099

5141. CHEMBL514643; SCHEMBL5058239; BDBM28187 ...
MW:     439.484240 g/mol MF: C22H21N3O5S
IUPAC name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-[(4-methoxyphenyl)metho...
Create Date: 2009-05-20
CID: 25263098

5142. CHEMBL514040; BDBM28186; benzimidazole thiophene analogue, 37 ...
MW:     434.467720 g/mol MF: C22H18N4O4S
IUPAC name: 3-[(3-cyanophenyl)methoxy]-5-(5,6-dimethoxybenzimidazol-1-yl...
Create Date: 2009-05-20
CID: 25263097

5143. CHEMBL475616; SCHEMBL5062746; BDBM28184 ...
MW:     452.526060 g/mol MF: C23H24N4O4S
IUPAC name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-[[3-(dimethylamino)phen...
Create Date: 2009-05-20
CID: 25263096

5144. CHEMBL474054; BDBM28183; benzimidazole thiophene analogue, 34 ...
MW:     439.484240 g/mol MF: C22H21N3O5S
IUPAC name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-[(2-methoxyphenyl)metho...
Create Date: 2009-05-20
CID: 25263095

5145. CHEMBL514634; SCHEMBL5058210; BDBM28181 ...
MW:     451.494940 g/mol MF: C23H21N3O5S
IUPAC name: 3-[(2-acetylphenyl)methoxy]-5-(5,6-dimethoxybenzimidazol-1-y...
Create Date: 2009-05-20
CID: 25263094

5146. CHEMBL474029; SCHEMBL5063343; BDBM28179 ...
MW:     434.467720 g/mol MF: C22H18N4O4S
IUPAC name: 3-[(2-cyanophenyl)methoxy]-5-(5,6-dimethoxybenzimidazol-1-yl...
Create Date: 2009-05-20
CID: 25263093

5147. GW852849X; BMCL191694 Compound 2; CHEMBL514162 ...
MW:     443.903320 g/mol MF: C21H18ClN3O4S
IUPAC name: 3-[(2-chlorophenyl)methoxy]-5-(5,6-dimethoxybenzimidazol-1-y...
Create Date: 2009-05-20
CID: 25263092

5148. CHEMBL475857; BDBM28176; benzimidazole thiophene analogue, 27 ...
MW:     409.458260 g/mol MF: C21H19N3O4S
IUPAC name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-phenylmethoxythiophene-...
Create Date: 2009-05-20
CID: 25263091

5149. CHEMBL514968; BDBM28174; benzimidazole thiophene analogue, 25 ...
MW:     447.430250 g/mol MF: C21H16F3N3O3S
IUPAC name: 5-(5-methoxybenzimidazol-1-yl)-3-[[2-(trifluoromethyl)phenyl...
Create Date: 2009-05-20
CID: 25263090

5150. CHEMBL519289; BDBM28172; benzimidazole thiophene analogue, 23 ...
MW:     495.494650 g/mol MF: C21H16F3N3O4S2
IUPAC name: 5-(5-methylsulfonylbenzimidazol-1-yl)-3-[[2-(trifluoromethyl...
Create Date: 2009-05-20
CID: 25263089

5151. GW853606X; CHEMBL481510; GTPL8645 ...
MW:     496.300330 g/mol MF: C20H13BrF3N3O2S
IUPAC name: 3-[(2-bromophenyl)methoxy]-5-[6-(trifluoromethyl)benzimidazo...
Create Date: 2009-05-20
CID: 25263088

5152. GW853609X; CHEMBL480371; BDBM28170 ...
MW:     496.300330 g/mol MF: C20H13BrF3N3O2S
IUPAC name: 3-[(2-bromophenyl)methoxy]-5-[5-(trifluoromethyl)benzimidazo...
Create Date: 2009-05-20
CID: 25263087

5153. CHEMBL519120; SCHEMBL5063333; BDBM28169 ...
MW:     397.877940 g/mol MF: C20H16ClN3O2S
IUPAC name: 5-(6-chlorobenzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]thi...
Create Date: 2009-05-20
CID: 25263086

5154. CHEMBL481492; SCHEMBL5058244; BDBM28168 ...
MW:     397.877940 g/mol MF: C20H16ClN3O2S
IUPAC name: 5-(5-chlorobenzimidazol-1-yl)-3-[(2-methylphenyl)methoxy]thi...
Create Date: 2009-05-20
CID: 25263085

5155. CHEMBL508763; BDBM28167; benzimidazole thiophene analogue, 18 ...
MW:     367.396763 g/mol MF: C19H14FN3O2S
IUPAC name: 5-(benzimidazol-1-yl)-3-[(2-fluorophenyl)methoxy]thiophene-2...
Create Date: 2009-05-20
CID: 25263084

5156. GSK1023156A; CHEMBL518953; BDBM28166 ...
MW:     428.302360 g/mol MF: C19H14BrN3O2S
IUPAC name: 5-(benzimidazol-1-yl)-3-[(2-bromophenyl)methoxy]thiophene-2-...
Create Date: 2009-05-20
CID: 25263083

5157. CHEMBL481156; SCHEMBL5062189; BDBM28164 ...
MW:     383.851360 g/mol MF: C19H14ClN3O2S
IUPAC name: 5-(benzimidazol-1-yl)-3-[(4-chlorophenyl)methoxy]thiophene-2...
Create Date: 2009-05-20
CID: 25263082

5158. CHEMBL445277; SCHEMBL5062579; BDBM28163 ...
MW:     383.851360 g/mol MF: C19H14ClN3O2S
IUPAC name: 5-(benzimidazol-1-yl)-3-[(3-chlorophenyl)methoxy]thiophene-2...
Create Date: 2009-05-20
CID: 25263081

5159. CHEMBL474603; BDBM28162; benzimidazole thiophene analogue, 13 ...
MW:     383.851360 g/mol MF: C19H14ClN3O2S
IUPAC name: 5-(benzimidazol-1-yl)-3-[(2-chlorophenyl)methoxy]thiophene-2...
Create Date: 2009-05-20
CID: 25263080

5160. CHEMBL474437; BDBM28161; benzimidazole thiophene analogue, 12 ...
MW:     379.432280 g/mol MF: C20H17N3O3S
IUPAC name: 5-(benzimidazol-1-yl)-3-[(4-methoxyphenyl)methoxy]thiophene-...
Create Date: 2009-05-20
CID: 25263079

5161. GW804482X; CHEMBL516248; SCHEMBL5058212 ...
MW:     379.432280 g/mol MF: C20H17N3O3S
IUPAC name: 5-(benzimidazol-1-yl)-3-[(3-methoxyphenyl)methoxy]thiophene-...
Create Date: 2009-05-20
CID: 25263078

5162. CHEMBL475597; BDBM28159; benzimidazole thiophene analogue, 10 ...
MW:     379.432280 g/mol MF: C20H17N3O3S
IUPAC name: 5-(benzimidazol-1-yl)-3-[(2-methoxyphenyl)methoxy]thiophene-...
Create Date: 2009-05-20
CID: 25263077

5163. CHEMBL460726; BDBM28022; trisubstituted pyridine analogue, 18h ...
MW:     518.991380 g/mol MF: C28H27ClN4O4
IUPAC name: 6-[(3-chlorophenyl)methylamino]-2-(2,6-dimethoxypyridin-3-yl...
Create Date: 2009-04-13
CID: 25218736

5164. CHEMBL514434; BDBM28021; trisubstituted pyridine analogue, 18g ...
MW:     548.029300 g/mol MF: C30H30ClN3O5
IUPAC name: 6-[(3-chlorophenyl)methylamino]-N-(2-phenoxyethyl)-2-(3,4,5-...
Create Date: 2009-04-13
CID: 25218735

5165. CHEMBL451383; BDBM28019; trisubstituted pyridine analogue, 18e ...
MW:     557.593740 g/mol MF: C31H31N3O7
IUPAC name: 6-(1,3-benzodioxol-5-ylmethylamino)-N-(2-phenoxyethyl)-2-(3,...
Create Date: 2009-04-13
CID: 25218734

5166. CHEMBL455406; BDBM28016; trisubstituted pyridine analogue, 18b ...
MW:     512.599480 g/mol MF: C30H32N4O4
IUPAC name: 6-[benzyl(ethyl)amino]-2-(2,6-dimethoxypyridin-3-yl)-N-(2-ph...
Create Date: 2009-04-13
CID: 25218733

5167. CHEMBL454386; SCHEMBL13996946; BDBM28015 ...
MW:     541.637400 g/mol MF: C32H35N3O5
IUPAC name: 6-[benzyl(ethyl)amino]-N-(2-phenoxyethyl)-2-(3,4,5-trimethox...
Create Date: 2009-04-13
CID: 25218732

5168. CHEMBL472580; BDBM27999; trisubstituted pyrimidine analogue, 6t ...
MW:     558.624860 g/mol MF: C31H34N4O6
IUPAC name: 2-[[(2R)-1-hydroxy-3-phenylpropan-2-yl]amino]-N-(2-phenoxyet...
Create Date: 2009-04-13
CID: 25218716

5169. CHEMBL494043; BDBM27997; trisubstituted pyrimidine analogue, 6r ...
MW:     529.586940 g/mol MF: C29H31N5O5
IUPAC name: N-(2-phenoxyethyl)-2-(2-pyridin-3-ylethylamino)-4-(3,4,5-tri...
Create Date: 2009-04-13
CID: 25218715

5170. CHEMBL494044; BDBM27996; trisubstituted pyrimidine analogue, 6q ...
MW:     529.586940 g/mol MF: C29H31N5O5
IUPAC name: N-(2-phenoxyethyl)-2-(2-pyridin-2-ylethylamino)-4-(3,4,5-tri...
Create Date: 2009-04-13
CID: 25218714

5171. CHEMBL523701; BDBM27995; trisubstituted pyrimidine analogue, 6p ...
MW:     558.624860 g/mol MF: C31H34N4O6
IUPAC name: 2-[2-(4-methoxyphenyl)ethylamino]-N-(2-phenoxyethyl)-4-(3,4,...
Create Date: 2009-04-13
CID: 25218713

5172. CHEMBL494441; BDBM27994; trisubstituted pyrimidine analogue, 6o ...
MW:     558.624860 g/mol MF: C31H34N4O6
IUPAC name: 2-[2-(3-methoxyphenyl)ethylamino]-N-(2-phenoxyethyl)-4-(3,4,...
Create Date: 2009-04-13
CID: 25218712

5173. CHEMBL494442; BDBM27993; trisubstituted pyrimidine analogue, 6n ...
MW:     558.624860 g/mol MF: C31H34N4O6
IUPAC name: 2-[2-(2-methoxyphenyl)ethylamino]-N-(2-phenoxyethyl)-4-(3,4,...
Create Date: 2009-04-13
CID: 25218711

5174. CHEMBL494646; BDBM27992; trisubstituted pyrimidine analogue, 6m ...
MW:     542.625460 g/mol MF: C31H34N4O5
IUPAC name: 2-[methyl(2-phenylethyl)amino]-N-(2-phenoxyethyl)-4-(3,4,5-t...
Create Date: 2009-04-13
CID: 25218710

5175. CHEMBL494647; BDBM27991; trisubstituted pyrimidine analogue, 6l ...
MW:     528.598880 g/mol MF: C30H32N4O5
IUPAC name: N-(2-phenoxyethyl)-2-(2-phenylethylamino)-4-(3,4,5-trimethox...
Create Date: 2009-04-13
CID: 25218709

5176. CHEMBL523443; BDBM27990; trisubstituted pyrimidine analogue, 6k ...
MW:     515.560360 g/mol MF: C28H29N5O5
IUPAC name: N-(2-phenoxyethyl)-2-(pyridin-3-ylmethylamino)-4-(3,4,5-trim...
Create Date: 2009-04-13
CID: 25218708

5177. CHEMBL490492; BDBM27989; trisubstituted pyrimidine analogue, 6j ...
MW:     515.560360 g/mol MF: C28H29N5O5
IUPAC name: N-(2-phenoxyethyl)-2-(pyridin-2-ylmethylamino)-4-(3,4,5-trim...
Create Date: 2009-04-13
CID: 25218707

5178. CHEMBL509410; BDBM27988; trisubstituted pyrimidine analogue, 6i ...
MW:     558.581800 g/mol MF: C30H30N4O7
IUPAC name: 2-(1,3-benzodioxol-5-ylmethylamino)-N-(2-phenoxyethyl)-4-(3,...
Create Date: 2009-04-13
CID: 25218706

5179. CHEMBL493228; BDBM27987; trisubstituted pyrimidine analogue, 6h ...
MW:     544.598280 g/mol MF: C30H32N4O6
IUPAC name: 2-[(3-methoxyphenyl)methylamino]-N-(2-phenoxyethyl)-4-(3,4,5...
Create Date: 2009-04-13
CID: 25218705

5180. CHEMBL523682; BDBM27986; trisubstituted pyrimidine analogue, 6g ...
MW:     544.598280 g/mol MF: C30H32N4O6
IUPAC name: 2-[(4-methoxyphenyl)methylamino]-N-(2-phenoxyethyl)-4-(3,4,5...
Create Date: 2009-04-13
CID: 25218704

5181. CHEMBL453360; BDBM27984; trisubstituted pyrimidine analogue, 6e ...
MW:     528.598880 g/mol MF: C30H32N4O5
IUPAC name: 2-[(2-methylphenyl)methylamino]-N-(2-phenoxyethyl)-4-(3,4,5-...
Create Date: 2009-04-13
CID: 25218703

5182. CHEMBL454158; BDBM27983; trisubstituted pyrimidine analogue, 6d ...
MW:     549.017360 g/mol MF: C29H29ClN4O5
IUPAC name: 2-[(2-chlorophenyl)methylamino]-N-(2-phenoxyethyl)-4-(3,4,5-...
Create Date: 2009-04-13
CID: 25218702

5183. CHEMBL510598; BDBM27982; trisubstituted pyrimidine analogue, 6c ...
MW:     528.598880 g/mol MF: C30H32N4O5
IUPAC name: 2-[benzyl(methyl)amino]-N-(2-phenoxyethyl)-4-(3,4,5-trimetho...
Create Date: 2009-04-13
CID: 25218701

5184. CHEMBL454374; BDBM27981; trisubstituted pyrimidine analogue, 6b ...
MW:     514.572300 g/mol MF: C29H30N4O5
IUPAC name: 2-(benzylamino)-N-(2-phenoxyethyl)-4-(3,4,5-trimethoxyphenyl...
Create Date: 2009-04-13
CID: 25218700

5185. CHEMBL454375; BDBM27980; trisubstituted pyrimidine analogue, 6a ...
MW:     494.582660 g/mol MF: C27H34N4O5
IUPAC name: 2-(3-methylbutylamino)-N-(2-phenoxyethyl)-4-(3,4,5-trimethox...
Create Date: 2009-04-13
CID: 25218699

5186. CHEMBL508063; SCHEMBL13996906; BDBM27979 ...
MW:     542.625460 g/mol MF: C31H34N4O5
IUPAC name: 2-[benzyl(ethyl)amino]-N-(2-phenoxyethyl)-4-(3,4,5-trimethox...
Create Date: 2009-04-13
CID: 25218698

5187. 802916-41-2; CHEMBL515828; BDBM28018 ...
MW:     528.598880 g/mol MF: C30H32N4O5
IUPAC name: 2-(2,6-dimethoxypyridin-3-yl)-6-[[(2S)-1-hydroxy-3-phenylpro...
Create Date: 2009-03-30
CID: 25198729

5188. CHEMBL518666; BDBM26314; thieno[3,2-d]pyrimidine analogue, 9 ...
MW:     448.424910 g/mol MF: C18H15F3N8OS
IUPAC name: 1-[1-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]triazol-4-yl...
Create Date: 2009-01-30
CID: 25138102

5189. CHEMBL462354; BDBM26313; thieno[3,2-d]pyrimidine analogue, 8 ...
MW:     447.436850 g/mol MF: C19H16F3N7OS
IUPAC name: 1-[1-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]imidazol-4-y...
Create Date: 2009-01-30
CID: 25138101

5190. CHEMBL462000; BDBM26312; thieno[3,2-d]pyrimidine analogue, 7 ...
MW:     457.471430 g/mol MF: C22H18F3N5OS
IUPAC name: 1-[3-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]phenyl]-3-[3...
Create Date: 2009-01-30
CID: 25138100

5191. CHEMBL461999; BDBM26311; thieno[3,2-d]pyrimidine analogue, 6 ...
MW:     457.471430 g/mol MF: C22H18F3N5OS
IUPAC name: 1-[4-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]phenyl]-3-[3...
Create Date: 2009-01-30
CID: 25138099

5192. CHEMBL461995; BDBM26310; thieno[3,2-d]pyrimidine analogue, 5 ...
MW:     442.456790 g/mol MF: C22H17F3N4OS
IUPAC name: 4-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]-N-[3-(trifluor...
Create Date: 2009-01-30
CID: 25138098

5193. CHEMBL459888; BDBM26309; thieno[3,2-d]pyrimidine analogue, 1 ...
MW:     442.456790 g/mol MF: C22H17F3N4OS
IUPAC name: N-[4-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]phenyl]-3-(t...
Create Date: 2009-01-30
CID: 25138097

5194. CHEMBL497854; SCHEMBL2121473; BDBM24694 ...
MW:     390.237840 g/mol MF: C15H16BrN7O
IUPAC name: 5-bromo-4-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-N-[(3-methyl-1...
Create Date: 2008-10-21
CID: 24971342

5195. CHEMBL412312; cid_276216; BDBM23836 ...
MW:     411.515440 g/mol MF: C26H21NO2S
IUPAC name: (2R)-2-amino-3-(9-naphthalen-1-ylfluoren-9-yl)sulfanylpropan...
Create Date: 2008-07-30
CID: 24860504

5196. CHEMBL271177; BDBM23835; ZINC5431417 ...
MW:     403.493440 g/mol MF: C24H21NO3S
IUPAC name: (2R)-2-acetamido-3-(9-phenylfluoren-9-yl)sulfanylpropanoic a...
Create Date: 2008-07-30
CID: 24860503

5197. CHEMBL269918; BDBM23833; ZINC5081021 ...
MW:     379.447223 g/mol MF: C22H18FNO2S
IUPAC name: (2R)-2-amino-3-[9-(4-fluorophenyl)fluoren-9-yl]sulfanylpropa...
Create Date: 2008-07-30
CID: 24860502

5198. CHEMBL411111; cid_276218; SCHEMBL7317498 ...
MW:     375.483340 g/mol MF: C23H21NO2S
IUPAC name: (2R)-2-amino-3-[9-(4-methylphenyl)fluoren-9-yl]sulfanylpropa...
Create Date: 2008-07-30
CID: 24860501

5199. CHEMBL513859; BDBM22197; GBR 12935 Analogue, (R)-32 ...
MW:     468.553750 g/mol MF: C28H31F3N2O
IUPAC name: 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-[(2R)-1-fluoro-3-p...
Create Date: 2008-07-07
CID: 24825336

5200. CHEMBL468208; BDBM22196; GBR 12935 Analogue, (S)-32 ...
MW:     468.553750 g/mol MF: C28H31F3N2O
IUPAC name: 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-[(2S)-1-fluoro-3-p...
Create Date: 2008-07-07
CID: 24825335

5201. CHEMBL468212; BDBM22181; GBR 12935 Analogue, (R)-10 ...
MW:     468.553750 g/mol MF: C28H31F3N2O
IUPAC name: 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-[(2R)-2-fluoro-3-p...
Create Date: 2008-07-07
CID: 24825325

5202. CHEMBL468211; BDBM22180; GBR 12935 Analogue, (S)-10 ...
MW:     468.553750 g/mol MF: C28H31F3N2O
IUPAC name: 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-[(2S)-2-fluoro-3-p...
Create Date: 2008-07-07
CID: 24825324

5203. CHEMBL468573; BDBM22179; GBR 12935 Analogue, (R)-9 ...
MW:     480.589266 g/mol MF: C29H34F2N2O2
IUPAC name: 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-[(2R)-2-methoxy-3-...
Create Date: 2008-07-07
CID: 24825323

5204. CHEMBL513858; BDBM22178; GBR 12935 Analogue, (S)-9 ...
MW:     480.589266 g/mol MF: C29H34F2N2O2
IUPAC name: 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-[(2S)-2-methoxy-3-...
Create Date: 2008-07-07
CID: 24825322

5205. CHEMBL466936; BDBM22177; GBR 12935 Analogue, (R)-8 ...
MW:     465.577926 g/mol MF: C28H33F2N3O
IUPAC name: (2R)-1-[4-[2-[bis(4-fluorophenyl)methoxy]ethyl]piperazin-1-y...
Create Date: 2008-07-07
CID: 24825321

5206. CHEMBL466145; BDBM22176; GBR 12935 Analogue, (S)-8 ...
MW:     465.577926 g/mol MF: C28H33F2N3O
IUPAC name: (2S)-1-[4-[2-[bis(4-fluorophenyl)methoxy]ethyl]piperazin-1-y...
Create Date: 2008-07-07
CID: 24825320

5207. BDBM22175; GBR 12935 Analogue, (-)-7; 1-[(2R)-2-benzylpropyl]-4-{2-[bis(4-fluorophenyl)methoxy]ethyl}piperazine
MW:     464.589866 g/mol MF: C29H34F2N2O
IUPAC name: 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-[(2R)-2-methyl-3-p...
Create Date: 2008-07-07
CID: 24825319

5208. BDBM22174; GBR 12935 Analogue, (+)-7; 1-[(2S)-2-benzylpropyl]-4-{2-[bis(4-fluorophenyl)methoxy]ethyl}piperazine
MW:     464.589866 g/mol MF: C29H34F2N2O
IUPAC name: 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-[(2S)-2-methyl-3-p...
Create Date: 2008-07-07
CID: 24825318

5209. 2pjt; CHEMBL236573; BDBM23502 ...
MW:     465.563040 g/mol MF: C22H31N3O6S
IUPAC name: tert-butyl 4-[[4-(but-2-ynylamino)phenyl]sulfonylmethyl]-4-(...
Create Date: 2008-04-23
CID: 24768528

5210. CHEMBL411244; SCHEMBL2076342; BDBM21334 ...
MW:     415.567120 g/mol MF: C28H33NO2
IUPAC name: [1-(oxan-4-ylmethyl)-6-phenylindol-3-yl]-(2,2,3,3-tetramethy...
Create Date: 2008-04-23
CID: 24768512

5211. CHEMBL270968; SCHEMBL2078481; BDBM21332 ...
MW:     368.512380 g/mol MF: C23H32N2O2
IUPAC name: [6-(aminomethyl)-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3-tet...
Create Date: 2008-04-23
CID: 24768511

5212. CHEMBL410655; SCHEMBL2076460; BDBM21331 ...
MW:     364.480620 g/mol MF: C23H28N2O2
IUPAC name: 1-(oxan-4-ylmethyl)-3-(2,2,3,3-tetramethylcyclopropanecarbon...
Create Date: 2008-04-23
CID: 24768510

5213. CHEMBL272189; SCHEMBL2076335; BDBM21330 ...
MW:     415.567120 g/mol MF: C28H33NO2
IUPAC name: [1-(oxan-4-ylmethyl)-5-phenylindol-3-yl]-(2,2,3,3-tetramethy...
Create Date: 2008-04-23
CID: 24768509

5214. CHEMBL406399; SCHEMBL2077037; BDBM21328 ...
MW:     383.523720 g/mol MF: C24H33NO3
IUPAC name: [5-(methoxymethyl)-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3-t...
Create Date: 2008-04-23
CID: 24768508

5215. CHEMBL410313; SCHEMBL2077199; BDBM21327 ...
MW:     369.497140 g/mol MF: C23H31NO3
IUPAC name: [5-(hydroxymethyl)-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3-t...
Create Date: 2008-04-23
CID: 24768507

5216. CHEMBL271553; SCHEMBL2078151; BDBM21326 ...
MW:     368.512380 g/mol MF: C23H32N2O2
IUPAC name: [5-(aminomethyl)-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3-tet...
Create Date: 2008-04-23
CID: 24768506

5217. CHEMBL409647; SCHEMBL2075662; BDBM21325 ...
MW:     364.480620 g/mol MF: C23H28N2O2
IUPAC name: 1-(oxan-4-ylmethyl)-3-(2,2,3,3-tetramethylcyclopropanecarbon...
Create Date: 2008-04-23
CID: 24768505

5218. CHEMBL259462; SCHEMBL2078086; BDBM21310 ...
MW:     354.485800 g/mol MF: C22H30N2O2
IUPAC name: [5-amino-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3-tetramethyl...
Create Date: 2008-04-23
CID: 24768499

5219. CHEMBL272868; BDBM21309; Tetrahydropyranyl-methyl analogue, 30 ...
MW:     383.480660 g/mol MF: C23H29NO4
IUPAC name: [5-(oxan-4-ylmethyl)-[1,3]dioxolo[4,5-f]indol-7-yl]-(2,2,3,3...
Create Date: 2008-04-23
CID: 24768498

5220. CHEMBL272176; SCHEMBL2078089; BDBM21308 ...
MW:     371.469960 g/mol MF: C22H29NO4
IUPAC name: [5,6-dihydroxy-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3-tetra...
Create Date: 2008-04-23
CID: 24768497

5221. CHEMBL270125; SCHEMBL2075566; BDBM21307 ...
MW:     385.496540 g/mol MF: C23H31NO4
IUPAC name: [5-hydroxy-6-methoxy-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3...
Create Date: 2008-04-23
CID: 24768496

5222. CHEMBL270987; SCHEMBL2077179; BDBM21306 ...
MW:     475.619080 g/mol MF: C30H37NO4
IUPAC name: [6-methoxy-1-(oxan-4-ylmethyl)-5-phenylmethoxyindol-3-yl]-(2...
Create Date: 2008-04-23
CID: 24768495

5223. CHEMBL271527; SCHEMBL2078072; BDBM21293 ...
MW:     417.561540 g/mol MF: C23H31NO4S
IUPAC name: [6-methylsulfonyl-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3-te...
Create Date: 2008-04-23
CID: 24768494

5224. CHEMBL410441; SCHEMBL2078443; BDBM21292 ...
MW:     407.469130 g/mol MF: C23H28F3NO2
IUPAC name: [1-(oxan-4-ylmethyl)-6-(trifluoromethyl)indol-3-yl]-(2,2,3,3...
Create Date: 2008-04-23
CID: 24768493

5225. CHEMBL271838; SCHEMBL2078775; BDBM21290 ...
MW:     418.367220 g/mol MF: C22H28BrNO2
IUPAC name: [6-bromo-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3-tetramethyl...
Create Date: 2008-04-23
CID: 24768492

5226. CHEMBL271782; BDBM21277; Pyrazole-3-carboxamide analogue, 44 ...
MW:     479.829800 g/mol MF: C23H25Cl3N4O
IUPAC name: N-cyclohexyl-5-(2,5-dimethylpyrrol-1-yl)-4-methyl-1-(2,4,6-t...
Create Date: 2008-04-23
CID: 24768487

5227. CHEMBL271611; BDBM21276; Pyrazole-3-carboxamide analogue, 43 ...
MW:     480.817860 g/mol MF: C22H24Cl3N5O
IUPAC name: 5-(2,5-dimethylpyrrol-1-yl)-4-methyl-N-piperidin-1-yl-1-(2,4...
Create Date: 2008-04-23
CID: 24768486

5228. CHEMBL411041; BDBM21275; Pyrazole-3-carboxamide analogue, 42 ...
MW:     528.645700 g/mol MF: C22H15Cl5N4O
IUPAC name: N-[(3,4-dichlorophenyl)methyl]-4-methyl-5-pyrrol-1-yl-1-(2,4...
Create Date: 2008-04-23
CID: 24768485

5229. CHEMBL260095; BDBM21274; Pyrazole-3-carboxamide analogue, 41 ...
MW:     452.764700 g/mol MF: C20H20Cl3N5O
IUPAC name: 4-methyl-N-piperidin-1-yl-5-pyrrol-1-yl-1-(2,4,6-trichloroph...
Create Date: 2008-04-23
CID: 24768484

5230. CHEMBL269919; BDBM21273; Pyrazole-3-carboxamide analogue, 40 ...
MW:     412.475546 g/mol MF: C23H26F2N4O
IUPAC name: N-cyclohexyl-1-(2,4-difluorophenyl)-5-(2,5-dimethylpyrrol-1-...
Create Date: 2008-04-23
CID: 24768483

5231. CHEMBL409150; BDBM21272; Pyrazole-3-carboxamide analogue, 39 ...
MW:     489.344606 g/mol MF: C24H20Cl2F2N4O
IUPAC name: N-[(3,4-dichlorophenyl)methyl]-1-(2,4-difluorophenyl)-5-(2,5...
Create Date: 2008-04-23
CID: 24768482

5232. CHEMBL272616; BDBM21271; Pyrazole-3-carboxamide analogue, 38 ...
MW:     413.463606 g/mol MF: C22H25F2N5O
IUPAC name: 1-(2,4-difluorophenyl)-5-(2,5-dimethylpyrrol-1-yl)-4-methyl-...
Create Date: 2008-04-23
CID: 24768481

5233. CHEMBL410912; BDBM21270; Pyrazole-3-carboxamide analogue, 37 ...
MW:     384.422386 g/mol MF: C21H22F2N4O
IUPAC name: N-cyclohexyl-1-(2,4-difluorophenyl)-4-methyl-5-pyrrol-1-ylpy...
Create Date: 2008-04-23
CID: 24768480

5234. CHEMBL410913; BDBM21269; Pyrazole-3-carboxamide analogue, 36 ...
MW:     461.291446 g/mol MF: C22H16Cl2F2N4O
IUPAC name: N-[(3,4-dichlorophenyl)methyl]-1-(2,4-difluorophenyl)-4-meth...
Create Date: 2008-04-23
CID: 24768479

5235. CHEMBL270345; BDBM21268; Pyrazole-3-carboxamide analogue, 35 ...
MW:     387.383266 g/mol MF: C19H19F2N5O2
IUPAC name: 1-(2,4-difluorophenyl)-4-methyl-N-morpholin-4-yl-5-pyrrol-1-...
Create Date: 2008-04-23
CID: 24768478

5236. CHEMBL408968; BDBM21267; Pyrazole-3-carboxamide analogue, 34 ...
MW:     385.410446 g/mol MF: C20H21F2N5O
IUPAC name: 1-(2,4-difluorophenyl)-4-methyl-N-piperidin-1-yl-5-pyrrol-1-...
Create Date: 2008-04-23
CID: 24768477

5237. CHEMBL271824; BDBM21266; Pyrazole-3-carboxamide analogue, 33 ...
MW:     445.384740 g/mol MF: C23H26Cl2N4O
IUPAC name: N-cyclohexyl-1-(3,4-dichlorophenyl)-5-(2,5-dimethylpyrrol-1-...
Create Date: 2008-04-23
CID: 24768476

5238. CHEMBL259042; BDBM21265; Pyrazole-3-carboxamide analogue, 32 ...
MW:     522.253800 g/mol MF: C24H20Cl4N4O
IUPAC name: 1-(3,4-dichlorophenyl)-N-[(3,4-dichlorophenyl)methyl]-5-(2,5...
Create Date: 2008-04-23
CID: 24768475

5239. CHEMBL259255; BDBM21264; Pyrazole-3-carboxamide analogue, 31 ...
MW:     446.372800 g/mol MF: C22H25Cl2N5O
IUPAC name: 1-(3,4-dichlorophenyl)-5-(2,5-dimethylpyrrol-1-yl)-4-methyl-...
Create Date: 2008-04-23
CID: 24768474

5240. CHEMBL272203; BDBM21263; Pyrazole-3-carboxamide analogue, 30 ...
MW:     417.331580 g/mol MF: C21H22Cl2N4O
IUPAC name: N-cyclohexyl-1-(3,4-dichlorophenyl)-4-methyl-5-pyrrol-1-ylpy...
Create Date: 2008-04-23
CID: 24768473

5241. CHEMBL272035; BDBM21262; Pyrazole-3-carboxamide analogue, 29 ...
MW:     494.200640 g/mol MF: C22H16Cl4N4O
IUPAC name: 1-(3,4-dichlorophenyl)-N-[(3,4-dichlorophenyl)methyl]-4-meth...
Create Date: 2008-04-23
CID: 24768472

5242. CHEMBL261381; BDBM21261; Pyrazole-3-carboxamide analogue, 28 ...
MW:     418.319640 g/mol MF: C20H21Cl2N5O
IUPAC name: 1-(3,4-dichlorophenyl)-4-methyl-N-piperidin-1-yl-5-pyrrol-1-...
Create Date: 2008-04-23
CID: 24768471

5243. CHEMBL261382; BDBM21260; Pyrazole-3-carboxamide analogue, 27 ...
MW:     445.384740 g/mol MF: C23H26Cl2N4O
IUPAC name: N-cyclohexyl-1-(2,4-dichlorophenyl)-5-(2,5-dimethylpyrrol-1-...
Create Date: 2008-04-23
CID: 24768470

5244. CHEMBL410727; BDBM21259; Pyrazole-3-carboxamide analogue, 26 ...
MW:     522.253800 g/mol MF: C24H20Cl4N4O
IUPAC name: 1-(2,4-dichlorophenyl)-N-[(3,4-dichlorophenyl)methyl]-5-(2,5...
Create Date: 2008-04-23
CID: 24768469

5245. CHEMBL259476; BDBM21258; Pyrazole-3-carboxamide analogue, 25 ...
MW:     446.372800 g/mol MF: C22H25Cl2N5O
IUPAC name: 1-(2,4-dichlorophenyl)-5-(2,5-dimethylpyrrol-1-yl)-4-methyl-...
Create Date: 2008-04-23
CID: 24768468

5246. CHEMBL406924; BDBM21257; Pyrazole-3-carboxamide analogue, 24 ...
MW:     417.331580 g/mol MF: C21H22Cl2N4O
IUPAC name: N-cyclohexyl-1-(2,4-dichlorophenyl)-4-methyl-5-pyrrol-1-ylpy...
Create Date: 2008-04-23
CID: 24768467

5247. CHEMBL259684; BDBM21256; Pyrazole-3-carboxamide analogue, 23 ...
MW:     494.200640 g/mol MF: C22H16Cl4N4O
IUPAC name: 1-(2,4-dichlorophenyl)-N-[(3,4-dichlorophenyl)methyl]-4-meth...
Create Date: 2008-04-23
CID: 24768466

5248. CHEMBL410728; BDBM21255; Pyrazole-3-carboxamide analogue, 22 ...
MW:     418.319640 g/mol MF: C20H21Cl2N5O
IUPAC name: 1-(2,4-dichlorophenyl)-4-methyl-N-piperidin-1-yl-5-pyrrol-1-...
Create Date: 2008-04-23
CID: 24768465

5249. CHEMBL270749; BDBM21254; Pyrazole-4-carboxamide analogue, 21 ...
MW:     459.755580 g/mol MF: C22H17Cl3N4O
IUPAC name: 1-(4-chlorophenyl)-N-[(3,4-dichlorophenyl)methyl]-3-methyl-5...
Create Date: 2008-04-23
CID: 24768464

5250. CHEMBL412252; BDBM21253; Pyrazole-4-carboxamide analogue, 20 ...
MW:     383.874580 g/mol MF: C20H22ClN5O
IUPAC name: 1-(4-chlorophenyl)-3-methyl-N-piperidin-1-yl-5-pyrrol-1-ylpy...
Create Date: 2008-04-23
CID: 24768463

5251. CHEMBL271610; BDBM21252; Pyrazole-3-carboxamide analogue, 19 ...
MW:     394.857460 g/mol MF: C20H19ClN6O
IUPAC name: 1-(4-chlorophenyl)-4-cyano-N-piperidin-1-yl-5-pyrrol-1-ylpyr...
Create Date: 2008-04-23
CID: 24768462

5252. CHEMBL271783; BDBM21251; Pyrazole-3-carboxamide analogue, 18 ...
MW:     396.913100 g/mol MF: C22H25ClN4O
IUPAC name: 1-(4-chlorophenyl)-N-(cyclohexylmethyl)-4-methyl-5-pyrrol-1-...
Create Date: 2008-04-23
CID: 24768461

5253. CHEMBL271988; BDBM21250; Pyrazole-3-carboxamide analogue, 17 ...
MW:     383.874580 g/mol MF: C20H22ClN5O
IUPAC name: 1-(4-chlorophenyl)-4-methyl-N-piperidin-1-yl-5-pyrrol-1-ylpy...
Create Date: 2008-04-23
CID: 24768460

5254. CHEMBL410496; BDBM21249; Pyrazole-3-carboxamide analogue, 16 ...
MW:     368.859940 g/mol MF: C20H21ClN4O
IUPAC name: 1-(4-chlorophenyl)-N-cyclohexyl-5-pyrrol-1-ylpyrazole-3-carb...
Create Date: 2008-04-23
CID: 24768459

5255. CHEMBL428610; BDBM21248; Pyrazole-3-carboxamide analogue, 15 ...
MW:     369.848000 g/mol MF: C19H20ClN5O
IUPAC name: 1-(4-chlorophenyl)-N-piperidin-1-yl-5-pyrrol-1-ylpyrazole-3-...
Create Date: 2008-04-23
CID: 24768458

5256. CHEMBL411112; BDBM21247; Pyrazole-3-carboxamide analogue, 14 ...
MW:     436.293400 g/mol MF: C22H15Cl2N5O
IUPAC name: 4-cyano-N-[(3,4-dichlorophenyl)methyl]-1-phenyl-5-pyrrol-1-y...
Create Date: 2008-04-23
CID: 24768457

5257. CHEMBL411303; BDBM21246; Pyrazole-3-carboxamide analogue, 13 ...
MW:     360.412400 g/mol MF: C20H20N6O
IUPAC name: 4-cyano-1-phenyl-N-piperidin-1-yl-5-pyrrol-1-ylpyrazole-3-ca...
Create Date: 2008-04-23
CID: 24768456

5258. CHEMBL261612; BDBM21245; Pyrazole-3-carboxamide analogue, 12 ...
MW:     349.429520 g/mol MF: C20H23N5O
IUPAC name: 4-methyl-1-phenyl-N-piperidin-1-yl-5-pyrrol-1-ylpyrazole-3-c...
Create Date: 2008-04-23
CID: 24768455

5259. CHEMBL411110; BDBM21243; Pyrazole-3-carboxamide analogue, 11 ...
MW:     335.402940 g/mol MF: C19H21N5O
IUPAC name: 1-phenyl-N-piperidin-1-yl-5-pyrrol-1-ylpyrazole-3-carboxamid...
Create Date: 2008-04-23
CID: 24768454

5260. CHEMBL475215; SCHEMBL4041358; BDBM28180 ...
MW:     487.548640 g/mol MF: C22H21N3O6S2
IUPAC name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-[(2-methylsulfonylpheny...
Create Date: 2008-02-29
CID: 24281531

5261. CHEMBL233763; BDBM17147; 2-imino-thiazolidin-4-one analog, 9 ...
MW:     419.474680 g/mol MF: C18H17N3O5S2
IUPAC name: (5Z)-2-amino-5-[[5-(4-morpholin-4-ylsulfonylphenyl)furan-2-y...
Create Date: 2008-01-19
CID: 23647655

5262. CHEMBL391493; BDBM17146; 2-imino-thiazolidin-4-one analog, 8 ...
MW:     418.489920 g/mol MF: C18H18N4O4S2
IUPAC name: (5Z)-2-amino-5-[[5-(4-piperazin-1-ylsulfonylphenyl)furan-2-y...
Create Date: 2008-01-19
CID: 23647654

5263. CHEMBL233554; BDBM17145; 2-imino-thiazolidin-4-one analog, 7 ...
MW:     420.505800 g/mol MF: C18H20N4O4S2
IUPAC name: 4-[5-[(Z)-(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]furan-...
Create Date: 2008-01-19
CID: 23647653

5264. 2uzb; CHEMBL233553; BDBM17144 ...
MW:     363.411420 g/mol MF: C15H13N3O4S2
IUPAC name: 4-[5-[(Z)-(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]furan-...
Create Date: 2008-01-19
CID: 23647652

5265. CHEMBL206708; SCHEMBL6857961; BDBM15120 ...
MW:     485.578980 g/mol MF: C31H27N5O
IUPAC name: (2S)-1-(1H-indol-3-yl)-3-[5-[(E)-2-(2-indol-1-ylpyridin-4-yl...
Create Date: 2008-01-19
CID: 23646995

5266. CHEMBL381610; SCHEMBL6855725; BDBM15119 ...
MW:     475.584160 g/mol MF: C30H29N5O
IUPAC name: 4-[(E)-2-[5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]pyridin-3...
Create Date: 2008-01-19
CID: 23646994

5267. CHEMBL203275; SCHEMBL6857930; BDBM15118 ...
MW:     425.525480 g/mol MF: C26H27N5O
IUPAC name: 4-[(E)-2-[5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]pyridin-3...
Create Date: 2008-01-19
CID: 23646993

5268. CHEMBL382914; SCHEMBL6855466; SCHEMBL6855477 ...
MW:     413.514780 g/mol MF: C25H27N5O
IUPAC name: 4-[(E)-2-[5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]pyridin-3...
Create Date: 2008-01-19
CID: 23646992

5269. CHEMBL202787; SCHEMBL6853249; BDBM15116 ...
MW:     399.488200 g/mol MF: C24H25N5O
IUPAC name: 4-[(E)-2-[5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]pyridin-3...
Create Date: 2008-01-19
CID: 23646991

5270. CHEMBL381260; SCHEMBL6855377; BDBM15114 ...
MW:     492.634520 g/mol MF: C30H28N4OS
IUPAC name: (2S)-1-[5-[(E)-2-(2-benzylsulfanylpyridin-4-yl)ethenyl]pyrid...
Create Date: 2008-01-19
CID: 23646990

5271. CHEMBL203483; BDBM15113; trans-bispyridinylethylene analog 10c ...
MW:     478.607940 g/mol MF: C29H26N4OS
IUPAC name: (2S)-1-(1H-indol-3-yl)-3-[5-[(E)-2-(2-phenylsulfanylpyridin-...
Create Date: 2008-01-19
CID: 23646989

5272. CHEMBL378823; SCHEMBL6853207; BDBM15112 ...
MW:     462.542340 g/mol MF: C29H26N4O2
IUPAC name: (2S)-1-(1H-indol-3-yl)-3-[5-[(E)-2-(2-phenoxypyridin-4-yl)et...
Create Date: 2008-01-19
CID: 23646988

5273. CHEMBL377294; SCHEMBL6853284; BDBM15111 ...
MW:     400.472960 g/mol MF: C24H24N4O2
IUPAC name: (2S)-1-(1H-indol-3-yl)-3-[5-[(E)-2-(2-methoxypyridin-4-yl)et...
Create Date: 2008-01-19
CID: 23646987

5274. CHEMBL202937; BDBM15104; trans-bispyridinylethylene analog 22b ...
MW:     354.447580 g/mol MF: C23H22N4
IUPAC name: 2-(1-methylindol-3-yl)-2-[5-[(E)-2-pyridin-4-ylethenyl]pyrid...
Create Date: 2008-01-19
CID: 23646980

5275. CHEMBL383254; BDBM15103; trans-bispyridinylethylene analog 22a ...
MW:     301.384960 g/mol MF: C20H19N3
IUPAC name: 2-phenyl-2-[5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl]ethana...
Create Date: 2008-01-19
CID: 23646979

5276. CHEMBL383527; BDBM15101; trans-bispyridinylethylene analog 17d ...
MW:     394.468380 g/mol MF: C25H22N4O
IUPAC name: (2S)-2-amino-3-naphthalen-1-yl-N-[5-[(E)-2-pyridin-4-ylethen...
Create Date: 2008-01-19
CID: 23646978

5277. CHEMBL205514; BDBM15100; trans-bispyridinylethylene analog 17c ...
MW:     344.409700 g/mol MF: C21H20N4O
IUPAC name: (2S)-2-amino-3-phenyl-N-[5-[(E)-2-pyridin-4-ylethenyl]pyridi...
Create Date: 2008-01-19
CID: 23646977

5278. CHEMBL379237; BDBM15099; trans-bispyridinylethylene analog 17b ...
MW:     334.375120 g/mol MF: C18H18N6O
IUPAC name: (2S)-2-amino-3-(1H-imidazol-5-yl)-N-[5-[(E)-2-pyridin-4-ylet...
Create Date: 2008-01-19
CID: 23646976

5279. CHEMBL381703; BDBM15096; trans-bispyridinylethylene analog 16b ...
MW:     405.923160 g/mol MF: C23H24ClN5
IUPAC name: (2S)-1-N-[6-chloro-5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl...
Create Date: 2008-01-19
CID: 23646975

5280. CHEMBL203384; BDBM15095; trans-bispyridinylethylene analog 16a ...
MW:     403.907280 g/mol MF: C23H22ClN5
IUPAC name: (2S)-1-N-[6-chloro-5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl...
Create Date: 2008-01-19
CID: 23646974

5281. Pyridine, 3-(5-methyl-1H-imidazol-1-yl)-; 837376-63-3; SCHEMBL3607993 ...
MW:     159.187860 g/mol MF: C9H9N3
IUPAC name: 3-(5-methylimidazol-1-yl)pyridine
Create Date: 2008-01-19
CID: 23646070

5282. 3-(3-methylthiophen-2-yl)pyridine; Pyridine, 3-(3-methyl-2-thienyl)-; CHEMBL179669 ...
MW:     175.250160 g/mol MF: C10H9NS
IUPAC name: 3-(3-methylthiophen-2-yl)pyridine
Create Date: 2008-01-19
CID: 23646069

5283. CHEMBL1189395; BDBM11692; Ganstigmine (CHF-2819) Analogue 9 ...
MW:     381.468080 g/mol MF: C22H27N3O3
IUPAC name: [(3aS,8bS)-3,4,8b-trimethyl-3-oxido-2,3a-dihydro-1H-pyrrolo[...
Create Date: 2008-01-19
CID: 23645750

5284. CHEMBL1196347; BDBM11691; Ganstigmine (CHF-2819) Analogue 8 ...
MW:     367.441500 g/mol MF: C21H25N3O3
IUPAC name: [(3aS,8bS)-3,4,8b-trimethyl-3-oxido-2,3a-dihydro-1H-pyrrolo[...
Create Date: 2008-01-19
CID: 23645748

5285. CHEMBL1189998; BDBM11690; Ganstigmine (CHF-2819) Analogue 7 ...
MW:     381.468080 g/mol MF: C22H27N3O3
IUPAC name: [(3aS,8bS)-3,4,8b-trimethyl-3-oxido-2,3a-dihydro-1H-pyrrolo[...
Create Date: 2008-01-19
CID: 23645746

5286. CHEMBL1189394; BDBM11689; Ganstigmine (CHF-2819) Analogue 6 ...
MW:     367.441500 g/mol MF: C21H25N3O3
IUPAC name: [(3aS,8bS)-3,4,8b-trimethyl-3-oxido-2,3a-dihydro-1H-pyrrolo[...
Create Date: 2008-01-19
CID: 23645744

5287. CHEMBL1190000; BDBM11688; Ganstigmine (CHF-2819) Analogue 5 ...
MW:     395.494660 g/mol MF: C23H29N3O3
IUPAC name: [(3aS,8bS)-3,4,8b-trimethyl-3-oxido-2,3a-dihydro-1H-pyrrolo[...
Create Date: 2008-01-19
CID: 23645742

5288. CHEMBL1196857; BDBM11687; Ganstigmine (CHF-2819) Analogue 4 ...
MW:     395.494660 g/mol MF: C23H29N3O3
IUPAC name: [(3aS,8bS)-3,4,8b-trimethyl-3-oxido-2,3a-dihydro-1H-pyrrolo[...
Create Date: 2008-01-19
CID: 23645740

5289. CHEMBL1189885; BDBM11685; Ganstigmine (CHF-2819) Analogue 2 ...
MW:     367.441500 g/mol MF: C21H25N3O3
IUPAC name: [(3aS,8bS)-3,4,8b-trimethyl-3-oxido-2,3a-dihydro-1H-pyrrolo[...
Create Date: 2008-01-19
CID: 23645737

5290. CHEMBL1190849; BDBM11684; Ganstigmine (CHF-2819) Analogue 1 ...
MW:     353.414920 g/mol MF: C20H23N3O3
IUPAC name: [(3aS,8bS)-3,4,8b-trimethyl-3-oxido-2,3a-dihydro-1H-pyrrolo[...
Create Date: 2008-01-19
CID: 23645735

5291. CHEMBL235905; BDBM19018; trifluoromethylpyrazole analogue, 36e ...
MW:     430.422950 g/mol MF: C22H21F3N4O2
IUPAC name: 6-[4-(dimethylamino)phenyl]-1-(4-methoxyphenyl)-3-(trifluoro...
Create Date: 2008-01-07
CID: 23635753

5292. CHEMBL391876; BDBM19016; trifluoromethylpyrazole analogue, 36c ...
MW:     416.396370 g/mol MF: C21H19F3N4O2
IUPAC name: 1-(4-methoxyphenyl)-6-[4-(methylamino)phenyl]-3-(trifluorome...
Create Date: 2008-01-07
CID: 23635752

5293. CHEMBL235694; BDBM19017; trifluoromethylpyrazole analogue, 36d ...
MW:     458.433050 g/mol MF: C23H21F3N4O3
IUPAC name: N-[4-[1-(4-methoxyphenyl)-7-oxo-3-(trifluoromethyl)-4,5-dihy...
Create Date: 2008-01-07
CID: 23635264

5294. BMCL193445 Compound 2d; CHEMBL236572; SCHEMBL3946150 ...
MW:     466.547800 g/mol MF: C22H30N2O7S
IUPAC name: tert-butyl 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-4-(hydrox...
Create Date: 2007-12-06
CID: 23513850

5295. CHEMBL230186; SCHEMBL8297186; BDBM25927 ...
MW:     305.376960 g/mol MF: C18H19N5
Create Date: 2007-12-05
CID: 20767725

5296. CHEMBL390201; SCHEMBL8295223; BDBM25924 ...
MW:     262.309160 g/mol MF: C16H14N4
Create Date: 2007-12-05
CID: 20767724

5297. CHEMBL381075; SCHEMBL6857586; BDBM15115 ...
MW:     385.461620 g/mol MF: C23H23N5O
IUPAC name: 4-[(E)-2-[5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]pyridin-3...
Create Date: 2007-12-05
CID: 20744789

5298. CHEMBL228990; SCHEMBL3389635; BDBM20798 ...
MW:     363.798820 g/mol MF: C16H18ClN5O3
IUPAC name: 9-[(2-chloro-3,4,5-trimethoxyphenyl)methyl]-6-methylpurin-2-...
Create Date: 2007-09-27
CID: 16736110

5299. CHEMBL388822; BDBM20797; 2-amino-6-halopurine analogue, 19e ...
MW:     394.223240 g/mol MF: C15H16BrN5O3
IUPAC name: 9-[(2-bromo-3,4,5-trimethoxyphenyl)methyl]purin-2-amine
Create Date: 2007-09-27
CID: 16735907

5300. CHEMBL228991; SCHEMBL3395476; BDBM20796 ...
MW:     426.288240 g/mol MF: C15H16BrN5O3S
IUPAC name: 2-amino-9-[(2-bromo-3,4,5-trimethoxyphenyl)methyl]-3H-purine...
Create Date: 2007-09-27
CID: 16735702

5301. CHEMBL390557; SCHEMBL3395258; BDBM20794 ...
MW:     424.249220 g/mol MF: C16H18BrN5O4
IUPAC name: 9-[(2-bromo-3,4,5-trimethoxyphenyl)methyl]-6-methoxypurin-2-...
Create Date: 2007-09-27
CID: 16735701

5302. CHEMBL388821; SCHEMBL3392871; BDBM20795 ...
MW:     365.771640 g/mol MF: C15H16ClN5O4
IUPAC name: 2-amino-9-[(2-chloro-3,4,5-trimethoxyphenyl)methyl]-3H-purin...
Create Date: 2007-09-27
CID: 16735070

5303. CHEMBL229692; SCHEMBL3389641; BDBM20793 ...
MW:     409.237880 g/mol MF: C15H17BrN6O3
IUPAC name: 9-[(2-bromo-3,4,5-trimethoxyphenyl)methyl]purine-2,6-diamine
Create Date: 2007-09-27
CID: 16735064

5304. CHEMBL388550; SCHEMBL3389579; BDBM20791 ...
MW:     475.668770 g/mol MF: C15H15ClIN5O3
IUPAC name: 6-chloro-9-[(2-iodo-3,4,5-trimethoxyphenyl)methyl]purin-2-am...
Create Date: 2007-09-27
CID: 16735063

5305. 3-(2-methyl-1H-imidazol-1-yl)pyridine; CHEMBL368883; Pyridine, 3-(2-methyl-1H-imidazol-1-yl)- ...
MW:     159.187860 g/mol MF: C9H9N3
IUPAC name: 3-(2-methylimidazol-1-yl)pyridine
Create Date: 2007-08-07
CID: 16654686

5306. 3-(pyridin-3-yl)propan-1-amine; 41038-69-1; 3-(3-PYRIDYL)PROPYLAMINE ...
MW:     136.194280 g/mol MF: C8H12N2
IUPAC name: 3-pyridin-3-ylpropan-1-amine
Create Date: 2007-02-08
CID: 13557523

5307. (5-phenylthiophen-2-yl)methanamine; 2-THIOPHENEMETHANAMINE, 5-PHENYL-; 58163-25-0 ...
MW:     189.276740 g/mol MF: C11H11NS
IUPAC name: (5-phenylthiophen-2-yl)methanamine
Create Date: 2007-02-05
CID: 11993875

5308. 3-(5-((methylthio)methyl)furan-2-yl)pyridine; Pyridine, 3-[5-[(methylthio)methyl]-2-furanyl]-; 859239-20-6 ...
MW:     205.276140 g/mol MF: C11H11NOS
IUPAC name: 3-[5-(methylsulfanylmethyl)furan-2-yl]pyridine
Create Date: 2007-02-05
CID: 11993873

5309. S-(5-(Pyridin-3-yl)furan-2-yl)methyl ethanethioate; Ethanethioic acid, S-[[5-(3-pyridinyl)-2-furanyl]methyl] ester; 859239-18-2 ...
MW:     233.286240 g/mol MF: C12H11NO2S
IUPAC name: S-[(5-pyridin-3-ylfuran-2-yl)methyl] ethanethioate
Create Date: 2007-02-05
CID: 11993872

5310. (5-phenylfuran-2-yl)methanamine; 1-(5-phenyl-2-furyl)methanamine; 39170-18-8 ...
MW:     173.211140 g/mol MF: C11H11NO
IUPAC name: (5-phenylfuran-2-yl)methanamine
Create Date: 2007-02-05
CID: 11993871

5311. (3-(pyridin-3-yl)-1H-pyrazol-5-yl)methanamine; [3-(pyridin-3-yl)-1H-pyrazol-5-yl]methanamine; CHEMBL385008 ...
MW:     174.202500 g/mol MF: C9H10N4
IUPAC name: (3-pyridin-3-yl-1H-pyrazol-5-yl)methanamine
Create Date: 2007-02-05
CID: 11993870

5312. 3-methyl-4-phenylthiophene; CHEMBL215183; SCHEMBL3609702 ...
MW:     174.262100 g/mol MF: C11H10S
IUPAC name: 3-methyl-4-phenylthiophene
Create Date: 2007-02-05
CID: 11993868

5313. Pyridine, 3-[5-(1,3-dithiolan-2-yl)-2-furanyl]-; 3-(5-[1,3]dithiolan-2-yl-furan-2-yl)pyridine; 859239-21-7 ...
MW:     249.351840 g/mol MF: C12H11NOS2
IUPAC name: 3-[5-(1,3-dithiolan-2-yl)furan-2-yl]pyridine
Create Date: 2007-02-05
CID: 11993867

5314. 2-Furanmethanethiol, 5-(3-pyridinyl)-; (5-pyridin-3-yl-furan-2-yl)methanethiol; 859239-19-3 ...
MW:     191.249560 g/mol MF: C10H9NOS
IUPAC name: (5-pyridin-3-ylfuran-2-yl)methanethiol
Create Date: 2007-02-05
CID: 11993866

5315. 543713-43-5; CHEMBRDG-BB 4010763; 1-(3-PYRIDIN-3-YLISOXAZOL-5-YL)METHANAMINE ...
MW:     175.187260 g/mol MF: C9H9N3O
IUPAC name: (3-pyridin-3-yl-1,2-oxazol-5-yl)methanamine
Create Date: 2007-02-05
CID: 11993865

5316. CHEMBL55799; BDBM13971; CTK6E1388 ...
MW:     511.566820 g/mol MF: C27H33N3O7
IUPAC name: 2-[4-[2-acetamido-3-oxo-3-(pentylamino)propyl]-2-ethyl-N-oxa...
Create Date: 2006-10-28
CID: 11827337

5317. CHEMBL67188; BDBM13962; Oxalylarylaminobenzoic Acid Analog 8f ...
MW:     375.374080 g/mol MF: C22H17NO5
IUPAC name: 2-(2-benzyl-N-oxaloanilino)benzoic acid
Create Date: 2006-10-28
CID: 11824932

5318. CHEMBL432339; BDBM13965; Oxalylarylaminobenzoic Acid Analog 8i ...
MW:     368.383200 g/mol MF: C20H20N2O5
IUPAC name: 2-(N-oxalo-2-piperidin-1-ylanilino)benzoic acid
Create Date: 2006-10-28
CID: 11824758

5319. CHEMBL67666; BDBM13974; Oxalylarylaminobenzoic Acid Analog 12e ...
MW:     566.645320 g/mol MF: C30H38N4O7
IUPAC name: 2-[4-[2-acetamido-3-oxo-3-(pentylamino)propyl]-N-oxalo-2-pip...
Create Date: 2006-10-27
CID: 11813772

5320. CHEMBL475783; SCHEMBL5065672; BDBM28185 ...
MW:     424.472900 g/mol MF: C21H20N4O4S
IUPAC name: 3-[(3-aminophenyl)methoxy]-5-(5,6-dimethoxybenzimidazol-1-yl...
Create Date: 2006-10-26
CID: 11743086

5321. CHEMBL2235515; BDBM13968; Oxalylarylaminobenzoic Acid Analog 20 ...
MW:     483.513660 g/mol MF: C25H29N3O7
IUPAC name: 2-[4-[(2S)-2-acetamido-3-oxo-3-(pentylamino)propyl]-N-oxaloa...
Create Date: 2006-10-26
CID: 11733586

5322. CHEMBL272659; SCHEMBL2078520; BDBM21323 ...
MW:     427.576280 g/mol MF: C26H37NO4
IUPAC name: [5-(4-hydroxybutoxy)-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3...
Create Date: 2006-10-26
CID: 11683348

5323. CHEMBL270546; SCHEMBL2078041; BDBM21304 ...
MW:     445.593100 g/mol MF: C29H35NO3
IUPAC name: [1-(oxan-4-ylmethyl)-6-phenylmethoxyindol-3-yl]-(2,2,3,3-tet...
Create Date: 2006-10-26
CID: 11669478

5324. CHEMBL272658; SCHEMBL2076358; BDBM21324 ...
MW:     490.472940 g/mol MF: C26H36BrNO3
IUPAC name: [5-(4-bromobutoxy)-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3-t...
Create Date: 2006-10-26
CID: 11648843

5325. CHEMBL411674; SCHEMBL2078003; BDBM21289 ...
MW:     373.916220 g/mol MF: C22H28ClNO2
IUPAC name: [6-chloro-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3-tetramethy...
Create Date: 2006-10-26
CID: 11646462

5326. CHEMBL209970; BDBM23500; beta-sulfonyl hydroxamate analogue, 4 ...
MW:     472.575520 g/mol MF: C20H28N2O7S2
IUPAC name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-N-hydroxy-1-propan-2...
Create Date: 2006-10-26
CID: 11634234

5327. SCHEMBL2031422; BDBM14394; Sildenafil 5-methyl ketone analogue 9 ...
MW:     446.501640 g/mol MF: C24H26N6O3
IUPAC name: 5-(5-acetyl-2-butoxypyridin-3-yl)-3-ethyl-2-(pyridin-2-ylmet...
Create Date: 2006-10-26
CID: 11633708

5328. CHEMBL271810; SCHEMBL2079421; BDBM21333 ...
MW:     397.507240 g/mol MF: C24H31NO4
IUPAC name: methyl 1-(oxan-4-ylmethyl)-3-(2,2,3,3-tetramethylcyclopropan...
Create Date: 2006-10-26
CID: 11632670

5329. CHEMBL272882; SCHEMBL2078587; BDBM21299 ...
MW:     369.497140 g/mol MF: C23H31NO3
IUPAC name: [5-methoxy-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3-tetrameth...
Create Date: 2006-10-26
CID: 11603123

5330. CHEMBL272876; SCHEMBL2076337; BDBM21303 ...
MW:     445.593100 g/mol MF: C29H35NO3
IUPAC name: [1-(oxan-4-ylmethyl)-5-phenylmethoxyindol-3-yl]-(2,2,3,3-tet...
Create Date: 2006-10-26
CID: 11597475

5331. CHEMBL408964; SCHEMBL2076878; BDBM21298 ...
MW:     369.497140 g/mol MF: C23H31NO3
IUPAC name: [4-methoxy-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3-tetrameth...
Create Date: 2006-10-26
CID: 11595817

5332. CHEMBL411631; SCHEMBL2077678; BDBM21301 ...
MW:     369.497140 g/mol MF: C23H31NO3
IUPAC name: [7-methoxy-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3-tetrameth...
Create Date: 2006-10-26
CID: 11595816

5333. BDBM9676; CHEMBL205307; SCH446211 (SCH6) Analog 9 ...
MW:     698.849360 g/mol MF: C36H54N6O8
IUPAC name: 2-methylpropyl N-[(1S)-1-cyclohexyl-2-[(2S)-2-[[1-[[2-[[(1S)...
Create Date: 2006-10-26
CID: 11592826

5334. CHEMBL259253; SCHEMBL2076333; BDBM21294 ...
MW:     355.470560 g/mol MF: C22H29NO3
IUPAC name: [4-hydroxy-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3-tetrameth...
Create Date: 2006-10-26
CID: 11581197

5335. CHEMBL409491; SCHEMBL2079121; BDBM21296 ...
MW:     355.470560 g/mol MF: C22H29NO3
IUPAC name: [6-hydroxy-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3-tetrameth...
Create Date: 2006-10-26
CID: 11559474

5336. CHEMBL271839; SCHEMBL2076363; BDBM21291 ...
MW:     353.497740 g/mol MF: C23H31NO2
IUPAC name: [6-methyl-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3-tetramethy...
Create Date: 2006-10-26
CID: 11559434

5337. CHEMBL271565; SCHEMBL2075943; BDBM21305 ...
MW:     445.593100 g/mol MF: C29H35NO3
IUPAC name: [1-(oxan-4-ylmethyl)-7-phenylmethoxyindol-3-yl]-(2,2,3,3-tet...
Create Date: 2006-10-26
CID: 11546775

5338. CHEMBL270955; SCHEMBL2078102; BDBM21295 ...
MW:     355.470560 g/mol MF: C22H29NO3
IUPAC name: [5-hydroxy-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3-tetrameth...
Create Date: 2006-10-26
CID: 11530502

5339. CHEMBL410842; SCHEMBL2078574; BDBM21302 ...
MW:     445.593100 g/mol MF: C29H35NO3
IUPAC name: [1-(oxan-4-ylmethyl)-4-phenylmethoxyindol-3-yl]-(2,2,3,3-tet...
Create Date: 2006-10-26
CID: 11517940

5340. CHEMBL271805; SCHEMBL2076993; BDBM21329 ...
MW:     397.507240 g/mol MF: C24H31NO4
IUPAC name: methyl 1-(oxan-4-ylmethyl)-3-(2,2,3,3-tetramethylcyclopropan...
Create Date: 2006-10-26
CID: 11516830

5341. CHEMBL269851; SCHEMBL2076365; BDBM21300 ...
MW:     369.497140 g/mol MF: C23H31NO3
IUPAC name: [6-methoxy-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3-tetrameth...
Create Date: 2006-10-26
CID: 11508949

5342. CHEMBL270082; SCHEMBL2075691; BDBM21297 ...
MW:     355.470560 g/mol MF: C22H29NO3
IUPAC name: [7-hydroxy-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3-tetrameth...
Create Date: 2006-10-26
CID: 11494137

5343. CHEMBL495263; BDBM27998; trisubstituted pyrimidine analogue, 6s ...
MW:     558.624860 g/mol MF: C31H34N4O6
IUPAC name: 2-[[(2S)-1-hydroxy-3-phenylpropan-2-yl]amino]-N-(2-phenoxyet...
Create Date: 2006-10-26
CID: 11478504

5344. CaSR antagonist 18c; CHEMBL457071; SCHEMBL13996885 ...
MW:     557.636800 g/mol MF: C32H35N3O6
IUPAC name: 6-[[(2S)-1-hydroxy-3-phenylpropan-2-yl]amino]-N-(2-phenoxyet...
Create Date: 2006-10-26
CID: 11410354

5345. CHEMBL229690; SCHEMBL3396299; BDBM20790 ...
MW:     428.668300 g/mol MF: C15H15BrClN5O3
IUPAC name: 9-[(2-bromo-3,4,5-trimethoxyphenyl)methyl]-6-chloropurin-2-a...
Create Date: 2006-10-26
CID: 11396254

5346. 3-(4-methylthiophen-3-yl)pyridine; Pyridine, 3-(4-methyl-3-thienyl)-; CHEMBL179704 ...
MW:     175.250160 g/mol MF: C10H9NS
IUPAC name: 3-(4-methylthiophen-3-yl)pyridine
Create Date: 2006-10-26
CID: 11378800

5347. CHEMBL360999; Pyridine, 3-(1-methyl-1H-imidazol-4-yl)-; 859238-88-3 ...
MW:     159.187860 g/mol MF: C9H9N3
IUPAC name: 3-(1-methylimidazol-4-yl)pyridine
Create Date: 2006-10-26
CID: 11344157

5348. (5-(PYRIDIN-3-YL)FURAN-2-YL)METHANAMINE; CHEMBL178090; CHEBI:41804 ...
MW:     174.199200 g/mol MF: C10H10N2O
IUPAC name: (5-pyridin-3-ylfuran-2-yl)methanamine
Create Date: 2006-10-26
CID: 11332763

5349. 837376-49-5; CHEMBL369285; N-Methyl-(5-pyrid-3-ylthien-2-yl)methylamine ...
MW:     204.291380 g/mol MF: C11H12N2S
IUPAC name: N-methyl-1-(5-pyridin-3-ylthiophen-2-yl)methanamine
Create Date: 2006-10-26
CID: 11321674

5350. CHEMBL361969; SCHEMBL3618712; BDBM12344 ...
MW:     218.317960 g/mol MF: C12H14N2S
IUPAC name: N,N-dimethyl-1-(5-pyridin-3-ylthiophen-2-yl)methanamine
Create Date: 2006-10-26
CID: 11310529

5351. CHEMBL493638; SCHEMBL13996883; BDBM27985 ...
MW:     549.017360 g/mol MF: C29H29ClN4O5
IUPAC name: 2-[(3-chlorophenyl)methylamino]-N-(2-phenoxyethyl)-4-(3,4,5-...
Create Date: 2006-10-26
CID: 11307362

5352. 3-(pyridin-3-yl)prop-2-yn-1-amine; 2-PROPYN-1-AMINE, 3-(3-PYRIDINYL)-; CHEMBL360541 ...
MW:     132.162520 g/mol MF: C8H8N2
IUPAC name: 3-pyridin-3-ylprop-2-yn-1-amine
Create Date: 2006-10-26
CID: 11263510

5353. CHEMBL178938; N-methyl(5-(pyridin-3-yl)furan-2-yl)methanamine; methyl({[5-(pyridin-3-yl)furan-2-yl]methyl})amine ...
MW:     188.225780 g/mol MF: C11H12N2O
IUPAC name: N-methyl-1-(5-pyridin-3-ylfuran-2-yl)methanamine
Create Date: 2006-10-26
CID: 11229234

5354. (5-PYRID-3-YLTHIEN-2-YL)METHYLAMINE; 837376-47-3; CHEMBL359657 ...
MW:     190.264800 g/mol MF: C10H10N2S
IUPAC name: (5-pyridin-3-ylthiophen-2-yl)methanamine
Create Date: 2006-10-26
CID: 11206290

5355. CHEMBL457249; SCHEMBL13996886; BDBM28020 ...
MW:     528.555820 g/mol MF: C29H28N4O6
IUPAC name: 6-(1,3-benzodioxol-5-ylmethylamino)-2-(2,6-dimethoxypyridin-...
Create Date: 2006-10-26
CID: 11203324

5356. CHEMBL388549; SCHEMBL3396053; BDBM20789 ...
MW:     384.217300 g/mol MF: C15H15Cl2N5O3
IUPAC name: 6-chloro-9-[(2-chloro-3,4,5-trimethoxyphenyl)methyl]purin-2-...
Create Date: 2006-10-26
CID: 11176568

5357. N,N-dimethyl(5-(pyridin-3-yl)furan-2-yl)methanamine; CHEMBL360998; SCHEMBL3604825 ...
MW:     202.252360 g/mol MF: C12H14N2O
IUPAC name: N,N-dimethyl-1-(5-pyridin-3-ylfuran-2-yl)methanamine
Create Date: 2006-10-26
CID: 11171679

5358. 2-fluoro-5-(3-methylthiophen-2-yl)pyridine; CHEMBL179621; Pyridine, 2-fluoro-5-(3-methyl-2-thienyl)- ...
MW:     193.240623 g/mol MF: C10H8FNS
IUPAC name: 2-fluoro-5-(3-methylthiophen-2-yl)pyridine
Create Date: 2006-10-26
CID: 11148236

5359. CHEMBL63291; BDBM13961; Oxalylarylaminobenzoic Acid Analog 8e ...
MW:     327.331280 g/mol MF: C18H17NO5
IUPAC name: 2-(N-oxalo-2-propan-2-ylanilino)benzoic acid
Create Date: 2006-10-26
CID: 11131230

5360. CHEMBL27490; CHEMBL357753; BDBM22171 ...
MW:     466.562686 g/mol MF: C28H32F2N2O2
IUPAC name: (2R)-1-[4-[2-[bis(4-fluorophenyl)methoxy]ethyl]piperazin-1-y...
Create Date: 2006-10-26
CID: 11102683

5361. CHEMBL282380; CHEMBL152173; BDBM22173 ...
MW:     430.581760 g/mol MF: C28H34N2O2
IUPAC name: (2R)-1-[4-(2-benzhydryloxyethyl)piperazin-1-yl]-3-phenylprop...
Create Date: 2006-10-26
CID: 11059071

5362. CHEMBL304960; BDBM13964; Oxalylarylaminobenzoic Acid Analog 8h ...
MW:     354.313560 g/mol MF: C18H14N2O6
IUPAC name: 2-[2-[(E)-3-amino-3-oxoprop-1-enyl]-N-oxaloanilino]benzoic a...
Create Date: 2006-10-26
CID: 11057341

5363. CHEMBL66590; SCHEMBL7066399; BDBM13959 ...
MW:     339.341980 g/mol MF: C19H17NO5
IUPAC name: 2-[oxalo(5,6,7,8-tetrahydronaphthalen-1-yl)amino]benzoic aci...
Create Date: 2006-10-26
CID: 11046051

5364. CHEMBL2235516; BDBM13969; Oxalylarylaminobenzoic Acid Analog 21 ...
MW:     519.567360 g/mol MF: C24H29N3O8S
IUPAC name: 2-[4-[(2S)-2-(methanesulfonamido)-3-oxo-3-(pentylamino)propy...
Create Date: 2006-10-26
CID: 11038621

5365. BDBM13967; Oxalylarylaminobenzoic Acid Analog 19; 2-{[4-(2-(S)-Amino-2-pentylcarbamoylethyl)phenyl]-oxalylamino}benzoic Acid ...
MW:     441.476980 g/mol MF: C23H27N3O6
IUPAC name: 2-[4-[(2S)-2-amino-3-oxo-3-(pentylamino)propyl]-N-oxaloanili...
Create Date: 2006-10-26
CID: 11015689

5366. CHEMBL308192; BDBM13960; Oxalylarylaminobenzoic Acid Analog 8d ...
MW:     313.304700 g/mol MF: C17H15NO5
IUPAC name: 2-(2-ethyl-N-oxaloanilino)benzoic acid
Create Date: 2006-10-26
CID: 11001493

5367. CHEMBL67187; SCHEMBL7062198; BDBM13963 ...
MW:     329.304100 g/mol MF: C17H15NO6
IUPAC name: 2-[2-(2-hydroxyethyl)-N-oxaloanilino]benzoic acid
Create Date: 2006-10-26
CID: 10892825

5368. CHEMBL561150; BDBM13966; Oxalylarylaminobenzoic Acid Analog 18
MW:     541.592800 g/mol MF: C28H35N3O8
IUPAC name: 2-[4-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxo-3...
Create Date: 2006-10-26
CID: 10875237

5369. CHEMBL65097; BDBM13972; Oxalylarylaminobenzoic Acid Analog 12c ...
MW:     525.593400 g/mol MF: C28H35N3O7
IUPAC name: 2-[4-[2-acetamido-3-oxo-3-(pentylamino)propyl]-N-oxalo-2-pro...
Create Date: 2006-10-26
CID: 10864326

5370. CHEMBL180270; SCHEMBL3619456; BDBM12350 ...
MW:     160.215680 g/mol MF: C10H12N2
IUPAC name: N,N-dimethyl-3-pyridin-3-ylprop-2-yn-1-amine
Create Date: 2006-10-25
CID: 10654534

5371. CHEMBL149808; SCHEMBL3613286; BDBM12349 ...
MW:     146.189100 g/mol MF: C9H10N2
IUPAC name: N-methyl-3-pyridin-3-ylprop-2-yn-1-amine
Create Date: 2006-10-25
CID: 10510985

5372. CHEMBL27646; CHEMBL153329; BDBM22170 ...
MW:     466.562686 g/mol MF: C28H32F2N2O2
IUPAC name: (2S)-1-[4-[2-[bis(4-fluorophenyl)methoxy]ethyl]piperazin-1-y...
Create Date: 2006-10-25
CID: 10479666

5373. CHEMBL28149; CHEMBL152779; BDBM22172 ...
MW:     430.581760 g/mol MF: C28H34N2O2
IUPAC name: (2S)-1-[4-(2-benzhydryloxyethyl)piperazin-1-yl]-3-phenylprop...
Create Date: 2006-10-25
CID: 10477812

5374. Kinome_3463; CHEMBL481491; SCHEMBL4551324 ...
MW:     417.404270 g/mol MF: C20H14F3N3O2S
IUPAC name: 5-(benzimidazol-1-yl)-3-[[2-(trifluoromethyl)phenyl]methoxy]...
Create Date: 2006-10-25
CID: 10409707

5375. CHEMBL235907; SCHEMBL2001907; BDBM19021 ...
MW:     498.496910 g/mol MF: C26H25F3N4O3
IUPAC name: 1-(4-methoxyphenyl)-6-[4-(2-oxoazepan-1-yl)phenyl]-3-(triflu...
Create Date: 2006-10-25
CID: 10300491

5376. CHEMBL392526; SCHEMBL2003955; BDBM19020 ...
MW:     484.470330 g/mol MF: C25H23F3N4O3
IUPAC name: 1-(4-methoxyphenyl)-6-[4-(2-oxopiperidin-1-yl)phenyl]-3-(tri...
Create Date: 2006-10-25
CID: 10299701

5377. CHEMBL474028; SCHEMBL5062225; BDBM28177 ...
MW:     488.354320 g/mol MF: C21H18BrN3O4S
IUPAC name: 3-[(2-bromophenyl)methoxy]-5-(5,6-dimethoxybenzimidazol-1-yl...
Create Date: 2006-10-25
CID: 10254917

5378. CHEMBL474843; SCHEMBL6041406; BDBM28175 ...
MW:     447.430250 g/mol MF: C21H16F3N3O3S
IUPAC name: 5-(6-methoxybenzimidazol-1-yl)-3-[[2-(trifluoromethyl)phenyl...
Create Date: 2006-10-25
CID: 10253033

5379. CHEMBL205415; SCHEMBL6854788; BDBM15098 ...
MW:     383.445740 g/mol MF: C23H21N5O
IUPAC name: (2S)-2-amino-3-(1H-indol-3-yl)-N-[5-[(E)-2-pyridin-4-ylethen...
Create Date: 2006-10-25
CID: 10172738

5380. CHEMBL203624; SCHEMBL6853481; SCHEMBL6853489 ...
MW:     369.462220 g/mol MF: C23H23N5
IUPAC name: (2S)-3-(1H-indol-3-yl)-1-N-[5-[(E)-2-pyridin-4-ylethenyl]pyr...
Create Date: 2006-10-25
CID: 10172517

5381. CHEMBL26477; CHEMBL149543; BDBM22169 ...
MW:     466.562686 g/mol MF: C28H32F2N2O2
IUPAC name: (1R)-3-[4-[2-[bis(4-fluorophenyl)methoxy]ethyl]piperazin-1-y...
Create Date: 2006-10-25
CID: 10096087

5382. CHEMBL514826; SCHEMBL5058139; BDBM28173 ...
MW:     495.494650 g/mol MF: C21H16F3N3O4S2
IUPAC name: 5-(6-methylsulfonylbenzimidazol-1-yl)-3-[[2-(trifluoromethyl...
Create Date: 2006-10-25
CID: 10074495

5383. CHEMBL26478; CHEMBL345154; BDBM22168 ...
MW:     466.562686 g/mol MF: C28H32F2N2O2
IUPAC name: (1S)-3-[4-[2-[bis(4-fluorophenyl)methoxy]ethyl]piperazin-1-y...
Create Date: 2006-10-25
CID: 10027543

5384. CHEMBL474053; SCHEMBL5065836; BDBM28182 ...
MW:     493.455630 g/mol MF: C22H18F3N3O5S
IUPAC name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-[[2-(trifluoromethoxy)p...
Create Date: 2006-10-25
CID: 9983158

5385. CHEMBL417564; SCHEMBL7064346; BDBM13957 ...
MW:     335.310220 g/mol MF: C19H13NO5
IUPAC name: 2-[naphthalen-2-yl(oxalo)amino]benzoic acid
Create Date: 2006-10-25
CID: 9923781

5386. CHEMBL209157; SCHEMBL314617; BDBM14392 ...
MW:     582.674460 g/mol MF: C27H34N8O5S
IUPAC name: 3-ethyl-5-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-(2-methoxyeth...
Create Date: 2006-10-25
CID: 9918515

5387. 232271-19-1; (S)-2-(2,6-Dichlorobenzamido)-3-(2',6'-dimethoxy-[1,1'-biphenyl]-4-yl)propanoic acid; TR-14035 ...
MW:     474.333240 g/mol MF: C24H21Cl2NO5
IUPAC name: (2S)-2-[(2,6-dichlorobenzoyl)amino]-3-[4-(2,6-dimethoxypheny...
Create Date: 2006-10-25
CID: 9912743

5388. CHEMBL67740; BDBM13973; Oxalylarylaminobenzoic Acid Analog 12d ...
MW:     527.566220 g/mol MF: C27H33N3O8
IUPAC name: 2-[4-[2-acetamido-3-oxo-3-(pentylamino)propyl]-2-(2-hydroxye...
Create Date: 2006-10-25
CID: 9871566

5389. 5-(5-acetyl-2-butoxy-3-pyridinyl)-3-ethyl-2-(1-ethyl-3-azetidinyl)-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one; 2chm; 5-[5-acetyl-2-butoxy-3-pyridinyl]-3-ethyl-2-(1-ethyl-3-azetidinyl)-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one ...
MW:     438.522700 g/mol MF: C23H30N6O3
IUPAC name: 5-(5-acetyl-2-butoxypyridin-3-yl)-3-ethyl-2-(1-ethylazetidin...
Create Date: 2006-10-25
CID: 9845992

5390. 3-(1H-pyrazol-3-yl)pyridine; 45887-08-9; 3-(1H-pyrazol-5-yl)pyridine ...
MW:     145.161280 g/mol MF: C8H7N3
IUPAC name: 3-(1H-pyrazol-5-yl)pyridine
Create Date: 2006-07-29
CID: 7074967

5391. STK004775; 4-(5-{[(5Z)-2-imino-4-oxo-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid; 4-{5-[(Z)-(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoic acid ...
MW:     314.315900 g/mol MF: C15H10N2O4S
IUPAC name: 4-[5-[(Z)-(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]furan-...
Create Date: 2005-09-12
CID: 5951796

5392. MLS000911622; SMR000718293; 4-[5-[(Z)-(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]furan-2-yl]benzenesulfonamide ...
MW:     349.384840 g/mol MF: C14H11N3O4S2
IUPAC name: 4-[5-[(Z)-(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]furan-...
Create Date: 2005-07-29
CID: 5729339

5393. AC1NR9UL; CHEMBL549752; BDBM13975 ...
MW:     588.629380 g/mol MF: C27H32N4O9S
IUPAC name: 2-[2-[(E)-3-amino-3-oxoprop-1-enyl]-4-[(2S)-2-(methanesulfon...
Create Date: 2005-11-29
CID: 5287526

5394. CHEMBL303333; AC1NBNHZ; BDBM13953 ...
MW:     533.572340 g/mol MF: C29H31N3O7
IUPAC name: 2-[[4-[2-acetamido-3-oxo-3-(pentylamino)propyl]naphthalen-1-...
Create Date: 2005-09-15
CID: 4470793

5395. NSC-123526; AC1MMYIL; NCIStruc1_001347 ...
MW:     395.901820 g/mol MF: C22H18ClNO2S
IUPAC name: (2R)-2-amino-3-[9-(4-chlorophenyl)fluoren-9-yl]sulfanylpropa...
Create Date: 2005-08-20
CID: 3246446

5396. 3-(1H-Imidazol-4-yl)pyridine; 51746-85-1; 3-(1H-imidazol-5-yl)pyridine ...
MW:     145.161280 g/mol MF: C8H7N3
IUPAC name: 3-(1H-imidazol-5-yl)pyridine
Create Date: 2005-08-09
CID: 3040177

5397. AC1MHYOC; BDBM4441; cyclic sulfamide, biphenyl analog 28 ...
MW:     594.676800 g/mol MF: C34H30N2O6S
IUPAC name: (4S,5S)-2,7-bis[[2-(1-benzofuran-2-yl)phenyl]methyl]-1,1-dio...
Create Date: 2005-08-01
CID: 3013792

5398. AC1MHYO9; BDBM4440; cyclic sulfamide, biphenyl analog 27 ...
MW:     526.690640 g/mol MF: C26H26N2O4S3
IUPAC name: (4S,5S)-1,1-dioxo-2,7-bis[(2-thiophen-3-ylphenyl)methyl]-1,2...
Create Date: 2005-08-01
CID: 3013791

5399. (4S,5S)-2,7-bis[[2-(2-methylsulfanylphenyl)phenyl]methyl]-1,1-dioxo-1,2,7-thiadiazepane-4,5-diol; AC1MHYO6; BDBM4439 ...
MW:     606.818360 g/mol MF: C32H34N2O4S3
IUPAC name: (4S,5S)-2,7-bis[[2-(2-methylsulfanylphenyl)phenyl]methyl]-1,...
Create Date: 2005-08-01
CID: 3013790

5400. (4S,5S)-2,7-bis[[2-(2-methoxyphenyl)phenyl]methyl]-1,1-dioxo-1,2,7-thiadiazepane-4,5-diol; AC1MHYO3; BDBM4438 ...
MW:     574.687160 g/mol MF: C32H34N2O6S
IUPAC name: (4S,5S)-2,7-bis[[2-(2-methoxyphenyl)phenyl]methyl]-1,1-dioxo...
Create Date: 2005-08-01
CID: 3013789

5401. (4S,5S)-2,7-bis[[2-(3,4-dimethoxyphenyl)phenyl]methyl]-1,1-dioxo-1,2,7-thiadiazepane-4,5-diol; AC1MHYO0; BDBM4437 ...
MW:     634.739120 g/mol MF: C34H38N2O8S
IUPAC name: (4S,5S)-2,7-bis[[2-(3,4-dimethoxyphenyl)phenyl]methyl]-1,1-d...
Create Date: 2005-08-01
CID: 3013788

5402. (4S,5S)-2,7-bis[[2-(3-nitrophenyl)phenyl]methyl]-1,1-dioxo-1,2,7-thiadiazepane-4,5-diol; AC1MHYNX; BDBM4436 ...
MW:     604.630320 g/mol MF: C30H28N4O8S
IUPAC name: (4S,5S)-2,7-bis[[2-(3-nitrophenyl)phenyl]methyl]-1,1-dioxo-1...
Create Date: 2005-08-01
CID: 3013787

5403. (4S,5S)-2,7-bis[[2-(4-ethylsulfonylphenyl)phenyl]methyl]-1,1-dioxo-1,2,7-thiadiazepane-4,5-diol; AC1MHYNU; BDBM4435 ...
MW:     698.869120 g/mol MF: C34H38N2O8S3
IUPAC name: (4S,5S)-2,7-bis[[2-(4-ethylsulfonylphenyl)phenyl]methyl]-1,1...
Create Date: 2005-08-01
CID: 3013786

5404. 1-[4-[2-[[(4S,5S)-7-[[2-(4-acetylphenyl)phenyl]methyl]-4,5-dihydroxy-1,1-dioxo-1,2,7-thiadiazepan-2-yl]methyl]phenyl]phenyl]ethanone; AC1MHYNR; BDBM4434 ...
MW:     598.708560 g/mol MF: C34H34N2O6S
IUPAC name: 1-[4-[2-[[(4S,5S)-7-[[2-(4-acetylphenyl)phenyl]methyl]-4,5-d...
Create Date: 2005-08-01
CID: 3013785

5405. (4S,5S)-2,7-bis[[2-(4-methoxyphenyl)phenyl]methyl]-1,1-dioxo-1,2,7-thiadiazepane-4,5-diol; AC1MHYNO; BDBM4433 ...
MW:     574.687160 g/mol MF: C32H34N2O6S
IUPAC name: (4S,5S)-2,7-bis[[2-(4-methoxyphenyl)phenyl]methyl]-1,1-dioxo...
Create Date: 2005-08-01
CID: 3013784

5406. (4S,5S)-1,1-dioxo-2,7-bis[[2-[3-(trifluoromethyl)phenyl]phenyl]methyl]-1,2,7-thiadiazepane-4,5-diol; AC1MHYNL; BDBM4432 ...
MW:     650.631139 g/mol MF: C32H28F6N2O4S
IUPAC name: (4S,5S)-1,1-dioxo-2,7-bis[[2-[3-(trifluoromethyl)phenyl]phen...
Create Date: 2005-08-01
CID: 3013783

5407. (4S,5S)-2,7-bis[[2-(4-fluorophenyl)phenyl]methyl]-1,1-dioxo-1,2,7-thiadiazepane-4,5-diol; AC1MHYNI; BDBM4431 ...
MW:     550.616126 g/mol MF: C30H28F2N2O4S
IUPAC name: (4S,5S)-2,7-bis[[2-(4-fluorophenyl)phenyl]methyl]-1,1-dioxo-...
Create Date: 2005-08-01
CID: 3013782

5408. AC1MHYNF; BDBM4430; cyclic sulfamide, biphenyl analog 17 ...
MW:     598.794680 g/mol MF: C36H42N2O4S
IUPAC name: (4S,5S)-1,1-dioxo-2,7-bis[[2-(3-propan-2-ylphenyl)phenyl]met...
Create Date: 2005-08-01
CID: 3013781

5409. (4S,5S)-2,7-bis[[2-(4-butylphenyl)phenyl]methyl]-1,1-dioxo-1,2,7-thiadiazepane-4,5-diol; AC1MHYNC; BDBM4429 ...
MW:     626.847840 g/mol MF: C38H46N2O4S
IUPAC name: (4S,5S)-2,7-bis[[2-(4-butylphenyl)phenyl]methyl]-1,1-dioxo-1...
Create Date: 2005-08-01
CID: 3013780

5410. AC1MHYN9; BDBM4428; cyclic sulfamide, biphenyl analog 15 ...
MW:     542.688360 g/mol MF: C32H34N2O4S
IUPAC name: (4S,5S)-2,7-bis[[2-(3-methylphenyl)phenyl]methyl]-1,1-dioxo-...
Create Date: 2005-08-01
CID: 3013779

5411. AC1MHYN6; BDBM4427; cyclic sulfamide, biphenyl analog 14 ...
MW:     542.688360 g/mol MF: C32H34N2O4S
IUPAC name: (4S,5S)-2,7-bis[[2-(4-methylphenyl)phenyl]methyl]-1,1-dioxo-...
Create Date: 2005-08-01
CID: 3013778

5412. (4S,5S)-1,1-dioxo-2,7-bis[(2-phenylphenyl)methyl]-1,2,7-thiadiazepane-4,5-diol; AC1MHYN3; BDBM4426 ...
MW:     514.635200 g/mol MF: C30H30N2O4S
IUPAC name: (4S,5S)-1,1-dioxo-2,7-bis[(2-phenylphenyl)methyl]-1,2,7-thia...
Create Date: 2005-08-01
CID: 3013777

5413. STK514411; (5Z)-2-imino-5-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-1,3-thiazolidin-4-one; AC1LNUCQ ...
MW:     315.303960 g/mol MF: C14H9N3O4S
IUPAC name: (5Z)-2-amino-5-[[5-(2-nitrophenyl)furan-2-yl]methylidene]-1,...
Create Date: 2005-07-10
CID: 1227681

5414. 3-(4-methylthiazol-2-yl)pyridine; ST51005355; 4-methyl-2-(pyridin-3-yl)thiazole ...
MW:     176.238220 g/mol MF: C9H8N2S
IUPAC name: 4-methyl-2-pyridin-3-yl-1,3-thiazole
Create Date: 2005-07-10
CID: 1201554

5415. GNF-PF-600; BAS 00282408; BDBM8464 ...
MW:     362.787540 g/mol MF: C16H11ClN2O4S
IUPAC name: 5-[[5-(3-chloro-4-methoxyphenyl)furan-2-yl]methylidene]-2-su...
Create Date: 2005-07-10
CID: 1138119

5416. AG-205/37007279; 5-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione; 5-{[5-(3,4-dichlorophenyl)furan-2-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione ...
MW:     367.206620 g/mol MF: C15H8Cl2N2O3S
IUPAC name: 5-[[5-(3,4-dichlorophenyl)furan-2-yl]methylidene]-2-sulfanyl...
Create Date: 2005-07-09
CID: 1041898

5417. STK846367; 5-[[5-(4-chlorophenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione; 5-{[5-(4-chlorophenyl)furan-2-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione ...
MW:     332.761560 g/mol MF: C15H9ClN2O3S
IUPAC name: 5-[[5-(4-chlorophenyl)furan-2-yl]methylidene]-2-sulfanyliden...
Create Date: 2005-07-07
CID: 689246

5418. 3-(3-Thienyl)pyridine; 3-(thiophen-3-yl)pyridine; 21308-81-6 ...
MW:     161.223580 g/mol MF: C9H7NS
IUPAC name: 3-thiophen-3-ylpyridine
Create Date: 2005-03-27
CID: 595254

5419. CHEMBL52723; AC1LA296; BDBM5240 ...
MW:     330.442940 g/mol MF: C15H26N2O4S
IUPAC name: (3S,4R,5S)-4-acetamido-5-amino-2-methylsulfanyl-3-pentan-3-y...
Create Date: 2005-08-01
CID: 505930

5420. CHEMBL57336; AC1LA293; BDBM5239 ...
MW:     318.796420 g/mol MF: C14H23ClN2O4
IUPAC name: (3S,4R,5S)-4-acetamido-5-amino-2-chloro-3-pentan-3-yloxycycl...
Create Date: 2005-08-01
CID: 505929

5421. 162152-08-1; dimethyl 5,10-dihydro-[1,3]benzodioxolo[5,6-f]indolizine-8,9-dicarboxylate; 1,3-Dioxolo(4,5-g)pyrrolo(1,2-b)isoquinoline-8,9-dicarboxylic acid, 5,10-dihydro-, dimethyl ester ...
MW:     329.304100 g/mol MF: C17H15NO6
IUPAC name: dimethyl 5,10-dihydro-[1,3]benzodioxolo[5,6-f]indolizine-8,9...
Create Date: 2005-08-01
CID: 461170

5422. AC1L9U6F; Penicillin, cHexMeNH-OHPrNH2 analog; 4-[[[3-[.beta.-[[(1,1-Dimethylethyl)amino]carbonyl]-.alpha.-methyl-cyclohexylethylamino]-2-hydroxypropyl]amino]carbonyl]-5,5-dimethyl-.alpha.-[(phenylacetyl)amino]-N-(phenylmethyl)-2-
MW:     737.006600 g/mol MF: C40H60N6O5S
IUPAC name: (2R,4S)-2-[(1R)-2-(benzylamino)-2-oxo-1-[(2-phenylacetyl)ami...
Create Date: 2005-08-01
CID: 456071

5423. AC1L9U63; Penicillin, 1Piperaz-OHPrNH2 analog; 4-[[[3-[2-[[(1,1-Dimethylethyl)amino]carbonyl]-4-(phenoxycarbonyl)-1-piperazinyl]-2(S)-hydroxypropyl]amino]carbonyl]-5,5-dimethyl-.alpha.-[(phenylacetyl)amino]-N-(phenylmethyl)-2-
MW:     801.993800 g/mol MF: C42H55N7O7S
IUPAC name: phenyl 4-[(2R)-3-[[(2R,4S)-2-[(1R)-2-(benzylamino)-2-oxo-1-[...
Create Date: 2005-08-01
CID: 456067

5424. AC1L9U56; Penicillin, 1Piperid-OHPrNH2 analog; 4-[[[3-[2-[[(1,1-Dimethylethyl)amino]carbonyl]-1-piperidinyl]-2-hydroxypropyl]amino]carbonyl]-5,5-dimethyl-.alpha.-[(phenylacetyl)amino]-N-(phenylmethyl)-2-thiazolidineacetamide, [2R-[2.alpha.(R*),4.
MW:     680.900280 g/mol MF: C36H52N6O5S
IUPAC name: (2R,4S)-2-[(1R)-2-(benzylamino)-2-oxo-1-[(2-phenylacetyl)ami...
Create Date: 2005-08-01
CID: 456056

5425. AC1L9SXZ; CHEMBL352145; LY289612 analog, sulfonyl isostere ...
MW:     673.778460 g/mol MF: C35H39N5O7S
IUPAC name: (2S)-N-[(2S,3S)-4-[2-(tert-butylcarbamoyl)phenyl]sulfonyl-3-...
Create Date: 2005-08-01
CID: 455494

5426. Boc-SAA-I-VV-OMe; AC1L9PRO; Statine analog (Boc-SAA-I-VV-OMe) ...
MW:     764.905900 g/mol MF: C37H60N6O11
IUPAC name: methyl (2S)-2-[[(2S)-2-[[(3S,4S)-3-hydroxy-4-[[(2S)-2-[[(2S)...
Create Date: 2005-08-01
CID: 451627

5427. 2-[(7-HYDROXY-NAPHTHALEN-1-YL)-OXALYL-AMINO]-BENZOIC ACID; COMPOUND 8B; 1onz ...
MW:     351.309620 g/mol MF: C19H13NO6
IUPAC name: 2-[(7-hydroxynaphthalen-1-yl)-oxaloamino]benzoic acid
Create Date: 2005-06-24
CID: 447695

5428. CHEMBL417656; RWJ-37947; 1eou ...
MW:     361.346100 g/mol MF: C9H15NO10S2
Create Date: 2005-06-24
CID: 445393

5429. 6,7-dimethoxyquinoline-5,8-dione; 59962-97-9; NSC76893 ...
MW:     219.193460 g/mol MF: C11H9NO4
IUPAC name: 6,7-dimethoxyquinoline-5,8-dione
Create Date: 2005-03-26
CID: 253696

5430. Mag-fura-2 AM; 130100-20-8; Mag-fura-2-acetoxymethyl ester ...
MW:     722.561200 g/mol MF: C30H30N2O19
IUPAC name: acetyloxymethyl 2-[5-[2-(acetyloxymethoxy)-2-oxoethoxy]-6-[b...
Create Date: 2005-07-19
CID: 131176

5431. 7,8-dichloro-1,2,3,4-tetrahydroisoquinoline; 61563-24-4; CHEMBL287837 ...
MW:     202.080460 g/mol MF: C9H9Cl2N
IUPAC name: 7,8-dichloro-1,2,3,4-tetrahydroisoquinoline
Create Date: 2005-08-08
CID: 123920

5432. BRN 1712578; Diethyl 1,2,2,2-tetrachloroethyl phosphate; AI3-20742 ...
MW:     319.934902 g/mol MF: C6H11Cl4O4P
IUPAC name: diethyl 1,2,2,2-tetrachloroethyl phosphate
Create Date: 2005-08-08
CID: 107199

5433. 3-Phenylthiophene; 2404-87-7; Thiophene, 3-phenyl- ...
MW:     160.235520 g/mol MF: C10H8S
IUPAC name: 3-phenylthiophene
Create Date: 2005-03-26
CID: 75473

5434. 4-Aminophenyl disulfide; 4,4'-Dithiodianiline; 722-27-0 ...
MW:     248.367080 g/mol MF: C12H12N2S2
IUPAC name: 4-[(4-aminophenyl)disulfanyl]aniline
Create Date: 2005-03-26
CID: 12875

5435. BDBM85290; Phosphinothricin analog, 3 (L Isomer)
MW:     195.110362 g/mol MF: C5H10NO5P
IUPAC name: 2-azaniumyl-4-[hydroxy(methyl)phosphoryl]-4-oxobutanoate
Create Date: 2015-10-07
CID: 91898947

5436. LEZVNJYAKQHCLD-UHFFFAOYSA-N; Fentanyl, 4-N-(5-cyanopentyl) analogue
MW:     327.463760 g/mol MF: C20H29N3O
IUPAC name: N-[1-(5-cyanopentyl)piperidin-4-yl]-N-phenylpropanamide
Create Date: 2015-04-28
CID: 91753686

5437. NTLIQBBVJIANCL-UHFFFAOYSA-N; Fentanyl, 4-N-(4-cyanobutyl) analogue
MW:     313.437180 g/mol MF: C19H27N3O
IUPAC name: N-[1-(4-cyanobutyl)piperidin-4-yl]-N-phenylpropanamide
Create Date: 2015-04-28
CID: 91753684

5438. WWVMNUMWFUXVSG-UHFFFAOYSA-N; JWH 018 N-(4,5-epoxypentyl) analog
MW:     355.429040 g/mol MF: C24H21NO2
IUPAC name: naphthalen-1-yl-[1-[3-(oxiran-2-yl)propyl]indol-3-yl]methano...
Create Date: 2015-04-28
CID: 91743670

5439. BBMRIHXVAUNKEV-UHFFFAOYSA-N; Fentanyl para methylphenyl acetyl analog; 1-[2-(4-methylphenyl)ethyl]-4-(N-acetanilido)piperidine
MW:     336.470520 g/mol MF: C22H28N2O
IUPAC name: N-[1-[2-(4-methylphenyl)ethyl]piperidin-4-yl]-N-phenylacetam...
Create Date: 2015-04-28
CID: 91736720

5440. CHEMBL2298727; AMBTUOJRPJZOOM-UHFFFAOYSA-N; Fentanyl, 4-N-(2-cyanoethyl) analogue ...
MW:     285.384020 g/mol MF: C17H23N3O
IUPAC name: N-[1-(2-cyanoethyl)piperidin-4-yl]-N-phenylpropanamide
Create Date: 2013-12-23
CID: 72201604

5441. 1356847-30-7; DTXSID40858067; ZINC77303131 ...
MW:     509.761400 g/mol MF: C30H55NO5
IUPAC name: [(2S)-1-[(2S,3S)-3-hexyl-4-oxooxetan-2-yl]tridecan-2-yl] (2S...
Create Date: 2013-11-01
CID: 71750450

5442. BDBM91642; Dihydro-1,5-benzothiazepine analog, 4
MW:     419.449780 g/mol MF: C23H17NO5S
IUPAC name: [2-formyloxy-4-[(4Z)-4-(6-oxocyclohexa-2,4-dien-1-ylidene)-3...
Create Date: 2012-07-07
CID: 57340890

5443. BDBM59234; Pyrazolopyrimidone analog, RGB-310591
MW:     525.813660 g/mol MF: C26H19Cl3N4O2
IUPAC name: 3-benzyl-6-[(4-methoxyphenyl)methyl]-1-(2,4,6-trichloropheny...
Create Date: 2011-09-02
CID: 53348075

5444. BDBM59233; Pyrazolopyrimidone analog, RGB-310590
MW:     435.691120 g/mol MF: C19H13Cl3N4O2
IUPAC name: 6-[(4-methoxyphenyl)methyl]-1-(2,4,6-trichlorophenyl)-2H-pyr...
Create Date: 2011-09-02
CID: 53348074

5445. BDBM59232; Pyrazolopyrimidone analog, RGB-310595
MW:     298.339720 g/mol MF: C16H18N4O2
IUPAC name: 6-[(4-methoxyphenyl)methyl]-3-propan-2-yl-1,2-dihydropyrazol...
Create Date: 2011-09-02
CID: 53348073

5446. BDBM59231; Pyrazolopyrimidone analog, RGB-310596
MW:     374.435680 g/mol MF: C22H22N4O2
IUPAC name: 6-[(4-methoxyphenyl)methyl]-1-phenyl-3-propan-2-yl-2H-pyrazo...
Create Date: 2011-09-02
CID: 53348072

5447. SCHEMBL10087335; BDBM59230; Pyrazolopyrimidone analog, RGB-285960
MW:     542.456860 g/mol MF: C27H29Cl2N5O3
IUPAC name: 1-(2,6-dichlorophenyl)-6-[[4-(2-morpholin-4-ylethoxy)phenyl]...
Create Date: 2011-09-02
CID: 53348071

5448. SCHEMBL10087355; BDBM59229; Pyrazolopyrimidone analog, RGB-286331
MW:     443.325800 g/mol MF: C22H20Cl2N4O2
IUPAC name: 1-(2,6-dichlorophenyl)-6-[(4-methoxyphenyl)methyl]-3-propan-...
Create Date: 2011-09-02
CID: 53348070

5449. BDBM50029032; Methyldisulfanyl analogue of coenzyme A
MW:     810.601886 g/mol MF: C22H35N7O16P3S2-3
IUPAC name: [5-(6-aminopurin-9-yl)-4-hydroxy-2-[[[[3-hydroxy-2,2-dimethy...
Create Date: 2009-11-19
CID: 44285467

5450. Dehydroxy analogue of norbinaltorphimine
MW:     645.786520 g/mol MF: C40H43N3O5
Create Date: 2009-11-19
CID: 44267009

5451. phosphinothricin; BDBM85288; CHEBI:58882 ...
MW:     180.118902 g/mol MF: C5H11NO4P-
IUPAC name: 2-azaniumyl-4-[methyl(oxido)phosphoryl]butanoate
Create Date: 2009-05-14
CID: 25244585

5452. CHEMBL454385; BDBM28014; trisubstituted pyrimidine analogue, 11o ...
MW:     562.016120 g/mol MF: C29H28ClN5O5
IUPAC name: 2-(1,3-benzodioxol-5-ylmethylamino)-N-[1-(4-chlorophenyl)pro...
Create Date: 2009-04-13
CID: 25218731

5453. CHEMBL458515; SCHEMBL13996928; BDBM28013 ...
MW:     525.555180 g/mol MF: C29H27N5O5
IUPAC name: [2-(1,3-benzodioxol-5-ylmethylamino)-4-(2,6-dimethoxypyridin...
Create Date: 2009-04-13
CID: 25218730

5454. CHEMBL458516; BDBM28012; trisubstituted pyrimidine analogue, 11m ...
MW:     529.543880 g/mol MF: C28H27N5O6
IUPAC name: 2-(1,3-benzodioxol-5-ylmethylamino)-4-(2,6-dimethoxypyridin-...
Create Date: 2009-04-13
CID: 25218729

5455. CHEMBL462661; BDBM28011; trisubstituted pyrimidine analogue, 11l ...
MW:     513.587540 g/mol MF: C29H31N5O4
IUPAC name: 2-[benzyl(ethyl)amino]-4-(2,6-dimethoxypyridin-3-yl)-N-(2-ph...
Create Date: 2009-04-13
CID: 25218728

5456. CHEMBL460727; BDBM28010; trisubstituted pyrimidine analogue, 11k ...
MW:     498.572900 g/mol MF: C29H30N4O4
IUPAC name: 2-[benzyl(methyl)amino]-4-(3,5-dimethoxyphenyl)-N-(2-phenoxy...
Create Date: 2009-04-13
CID: 25218727

5457. CHEMBL473345; BDBM28009; trisubstituted pyrimidine analogue, 11j ...
MW:     498.572900 g/mol MF: C29H30N4O4
IUPAC name: 2-[benzyl(methyl)amino]-4-(3,4-dimethoxyphenyl)-N-(2-phenoxy...
Create Date: 2009-04-13
CID: 25218726

5458. CHEMBL472731; SCHEMBL13996892; BDBM28008 ...
MW:     506.518910 g/mol MF: C28H25F3N4O2
IUPAC name: 2-[benzyl(methyl)amino]-N-(2-phenoxyethyl)-4-[4-(trifluorome...
Create Date: 2009-04-13
CID: 25218725

5459. CHEMBL472732; BDBM28007; trisubstituted pyrimidine analogue, 11h ...
MW:     468.546920 g/mol MF: C28H28N4O3
IUPAC name: 2-[benzyl(methyl)amino]-4-(4-methoxyphenyl)-N-(2-phenoxyethy...
Create Date: 2009-04-13
CID: 25218724

5460. CHEMBL472932; BDBM28006; trisubstituted pyrimidine analogue, 11g ...
MW:     468.546920 g/mol MF: C28H28N4O3
IUPAC name: 2-[benzyl(methyl)amino]-4-(3-methoxyphenyl)-N-(2-phenoxyethy...
Create Date: 2009-04-13
CID: 25218723

5461. CHEMBL472933; BDBM28005; trisubstituted pyrimidine analogue, 11f ...
MW:     468.546920 g/mol MF: C28H28N4O3
IUPAC name: 2-[benzyl(methyl)amino]-4-(2-methoxyphenyl)-N-(2-phenoxyethy...
Create Date: 2009-04-13
CID: 25218722

5462. CHEMBL511485; BDBM28004; trisubstituted pyrimidine analogue, 11e ...
MW:     554.679220 g/mol MF: C33H38N4O4
IUPAC name: 2-[benzyl(ethyl)amino]-N-(4-phenylbutyl)-4-(3,4,5-trimethoxy...
Create Date: 2009-04-13
CID: 25218721

5463. CHEMBL472406; BDBM28003; trisubstituted pyrimidine analogue, 11d ...
MW:     540.652640 g/mol MF: C32H36N4O4
IUPAC name: 2-[benzyl(ethyl)amino]-N-(3-phenylpropyl)-4-(3,4,5-trimethox...
Create Date: 2009-04-13
CID: 25218720

5464. CHEMBL472407; BDBM28002; trisubstituted pyrimidine analogue, 11c ...
MW:     526.626060 g/mol MF: C31H34N4O4
IUPAC name: 2-[benzyl(ethyl)amino]-N-(2-phenylethyl)-4-(3,4,5-trimethoxy...
Create Date: 2009-04-13
CID: 25218719

5465. CHEMBL473341; BDBM28001; trisubstituted pyrimidine analogue, 11b ...
MW:     458.595160 g/mol MF: C28H34N4O2
IUPAC name: 2-[benzyl(ethyl)amino]-4-cyclohexyl-N-(2-phenoxyethyl)pyrimi...
Create Date: 2009-04-13
CID: 25218718

5466. CHEMBL473342; BDBM28000; trisubstituted pyrimidine analogue, 11a ...
MW:     452.547520 g/mol MF: C28H28N4O2
IUPAC name: 2-[benzyl(ethyl)amino]-N-(2-phenoxyethyl)-4-phenylpyrimidine...
Create Date: 2009-04-13
CID: 25218717

5467. CHEMBL519728; SCHEMBL13242849; BDBM26334 ...
MW:     479.620900 g/mol MF: C23H25N7OS2
IUPAC name: 1-[3-[2-(azetidin-1-yl)ethyl]phenyl]-3-[5-[2-(thieno[3,2-d]p...
Create Date: 2009-01-30
CID: 25138120

5468. CHEMBL486850; SCHEMBL13242855; BDBM26333 ...
MW:     547.618870 g/mol MF: C24H24F3N7OS2
IUPAC name: 1-[3-(pyrrolidin-1-ylmethyl)-5-(trifluoromethyl)phenyl]-3-[5...
Create Date: 2009-01-30
CID: 25138119

5469. CHEMBL487892; SCHEMBL13242971; BDBM26332 ...
MW:     402.536880 g/mol MF: C18H22N6OS2
IUPAC name: 1-cyclohexyl-3-[5-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl...
Create Date: 2009-01-30
CID: 25138118

5470. CHEMBL486877; SCHEMBL13672170; BDBM26331 ...
MW:     435.525280 g/mol MF: C20H17N7OS2
IUPAC name: 1-(1H-indol-7-yl)-3-[5-[2-(thieno[3,2-d]pyrimidin-4-ylamino)...
Create Date: 2009-01-30
CID: 25138117

5471. CHEMBL520053; SCHEMBL13242814; BDBM26330 ...
MW:     448.924763 g/mol MF: C18H14ClFN6OS2
IUPAC name: 1-(3-chloro-4-fluorophenyl)-3-[5-[2-(thieno[3,2-d]pyrimidin-...
Create Date: 2009-01-30
CID: 25138116

5472. CHEMBL505037; SCHEMBL13242817; BDBM26329 ...
MW:     465.379360 g/mol MF: C18H14Cl2N6OS2
IUPAC name: 1-(3,4-dichlorophenyl)-3-[5-[2-(thieno[3,2-d]pyrimidin-4-yla...
Create Date: 2009-01-30
CID: 25138115

5473. CHEMBL472546; SCHEMBL16500677; BDBM26328 ...
MW:     430.934300 g/mol MF: C18H15ClN6OS2
IUPAC name: 1-(2-chlorophenyl)-3-[5-[2-(thieno[3,2-d]pyrimidin-4-ylamino...
Create Date: 2009-01-30
CID: 25138114

5474. CHEMBL472377; SCHEMBL13242798; BDBM26327 ...
MW:     430.934300 g/mol MF: C18H15ClN6OS2
IUPAC name: 1-(4-chlorophenyl)-3-[5-[2-(thieno[3,2-d]pyrimidin-4-ylamino...
Create Date: 2009-01-30
CID: 25138113

5475. CHEMBL512184; SCHEMBL13242810; BDBM26325 ...
MW:     414.479703 g/mol MF: C18H15FN6OS2
IUPAC name: 1-(3-fluorophenyl)-3-[5-[2-(thieno[3,2-d]pyrimidin-4-ylamino...
Create Date: 2009-01-30
CID: 25138112

5476. CHEMBL471337; SCHEMBL13242840; BDBM26324 ...
MW:     420.510640 g/mol MF: C20H16N6OS2
IUPAC name: 1-(3-ethynylphenyl)-3-[5-[2-(thieno[3,2-d]pyrimidin-4-ylamin...
Create Date: 2009-01-30
CID: 25138111

5477. CHEMBL470119; BDBM26323; thieno[3,2-d]pyrimidine analogue, 18 ...
MW:     426.515220 g/mol MF: C19H18N6O2S2
IUPAC name: 1-(3-methoxyphenyl)-3-[5-[2-(thieno[3,2-d]pyrimidin-4-ylamin...
Create Date: 2009-01-30
CID: 25138110

5478. CHEMBL513078; SCHEMBL13242772; BDBM26322 ...
MW:     410.515820 g/mol MF: C19H18N6OS2
IUPAC name: 1-(3-methylphenyl)-3-[5-[2-(thieno[3,2-d]pyrimidin-4-ylamino...
Create Date: 2009-01-30
CID: 25138109

5479. CHEMBL472203; BDBM26321; thieno[3,2-d]pyrimidine analogue, 16 ...
MW:     410.515820 g/mol MF: C19H18N6OS2
IUPAC name: 1-methyl-1-phenyl-3-[5-[2-(thieno[3,2-d]pyrimidin-4-ylamino)...
Create Date: 2009-01-30
CID: 25138108

5480. CHEMBL472202; SCHEMBL13242774; BDBM26320 ...
MW:     396.489240 g/mol MF: C18H16N6OS2
IUPAC name: 1-phenyl-3-[5-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]-1,...
Create Date: 2009-01-30
CID: 25138107

5481. CHEMBL471511; BDBM26319; thieno[3,2-d]pyrimidine analogue, 14 ...
MW:     463.499150 g/mol MF: C20H16F3N5OS2
IUPAC name: 2-[5-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]-1,3-thiazol...
Create Date: 2009-01-30
CID: 25138106

5482. CHEMBL471169; BDBM26318; thieno[3,2-d]pyrimidine analogue, 13 ...
MW:     463.499150 g/mol MF: C20H16F3N5OS2
IUPAC name: N-[5-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]-1,3-thiazol...
Create Date: 2009-01-30
CID: 25138105

5483. CHEMBL472194; BDBM26317; thieno[3,2-d]pyrimidine analogue, 12 ...
MW:     449.472570 g/mol MF: C19H14F3N5OS2
IUPAC name: N-[5-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]-1,3-thiazol...
Create Date: 2009-01-30
CID: 25138104

5484. CHEMBL513076; BDBM26316; thieno[3,2-d]pyrimidine analogue, 11 ...
MW:     464.487210 g/mol MF: C19H15F3N6OS2
IUPAC name: 1-[4-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]-1,3-thiazol...
Create Date: 2009-01-30
CID: 25138103

5485. CHEMBL472193; 1-{5-[2-(Thieno[3,2-D]pyrimidin-4-Ylamino)ethyl]-1,3-Thiazol-2-Yl}-3-[3-(Trifluoromethyl)phenyl]urea; 3-[5-(2-{thieno[3,2-d]pyrimidin-4-ylamino}ethyl)-1,3-thiazol-2-yl]-1-[3-(trifluoromethyl)phenyl]urea ...
MW:     464.487210 g/mol MF: C19H15F3N6OS2
IUPAC name: 1-[5-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]-1,3-thiazol...
Create Date: 2008-08-30
CID: 24880024

5486. CHEMBL394003; BDBM23514; beta-sulfonyl hydroxamate analogue, 28 ...
MW:     500.628680 g/mol MF: C22H32N2O7S2
IUPAC name: N-hydroxy-4-[[4-(2-methylpent-3-yn-2-yloxy)phenyl]sulfonylme...
Create Date: 2008-07-30
CID: 24860430

5487. CHEMBL236806; BDBM23513; beta-sulfonyl hydroxamate analogue, 27 ...
MW:     486.602100 g/mol MF: C21H30N2O7S2
IUPAC name: N-hydroxy-4-[(4-pent-3-yn-2-yloxyphenyl)sulfonylmethyl]-1-pr...
Create Date: 2008-07-30
CID: 24860429

5488. CHEMBL238081; BDBM23512; beta-sulfonyl hydroxamate analogue, 26 ...
MW:     397.512220 g/mol MF: C17H23N3O4S2
IUPAC name: (3S)-4-[4-(but-2-ynylamino)phenyl]sulfonyl-N-hydroxy-2,2-dim...
Create Date: 2008-07-30
CID: 24860428

5489. CHEMBL400430; BDBM23510; beta-sulfonyl hydroxamate analogue, 21 ...
MW:     449.563640 g/mol MF: C22H31N3O5S
IUPAC name: 4-[[4-(but-2-ynylamino)phenyl]sulfonylmethyl]-N-hydroxy-1-(2...
Create Date: 2008-07-30
CID: 24860427

5490. CHEMBL236400; BDBM23509; beta-sulfonyl hydroxamate analogue, 20 ...
MW:     483.579860 g/mol MF: C25H29N3O5S
IUPAC name: 4-[[4-(but-2-ynylamino)phenyl]sulfonylmethyl]-N-hydroxy-1-(2...
Create Date: 2008-07-30
CID: 24860426

5491. CHEMBL399401; BDBM23508; beta-sulfonyl hydroxamate analogue, 19 ...
MW:     464.578280 g/mol MF: C22H32N4O5S
IUPAC name: 4-[[4-(but-2-ynylamino)phenyl]sulfonylmethyl]-1-N,1-N-diethy...
Create Date: 2008-07-30
CID: 24860425

5492. CHEMBL237468; BDBM23507; beta-sulfonyl hydroxamate analogue, 18 ...
MW:     456.557820 g/mol MF: C23H28N4O4S
IUPAC name: 4-[[4-(but-2-ynylamino)phenyl]sulfonylmethyl]-N-hydroxy-1-(p...
Create Date: 2008-07-30
CID: 24860424

5493. CHEMBL237467; BDBM23506; beta-sulfonyl hydroxamate analogue, 17 ...
MW:     471.590760 g/mol MF: C20H29N3O6S2
IUPAC name: 4-[[4-(but-2-ynylamino)phenyl]sulfonylmethyl]-N-hydroxy-1-pr...
Create Date: 2008-07-30
CID: 24860423

5494. CHEMBL237466; BDBM23505; beta-sulfonyl hydroxamate analogue, 16 ...
MW:     365.447220 g/mol MF: C17H23N3O4S
IUPAC name: 4-[[4-(but-2-ynylamino)phenyl]sulfonylmethyl]-N-hydroxypiper...
Create Date: 2008-07-30
CID: 24860422

5495. CHEMBL399400; BDBM23504; beta-sulfonyl hydroxamate analogue, 12
MW:     481.562440 g/mol MF: C22H31N3O7S
IUPAC name: tert-butyl 4-[[4-(4-hydroxybut-2-ynylamino)phenyl]sulfonylme...
Create Date: 2008-07-30
CID: 24860421

5496. CHEMBL236574; BDBM23503; beta-sulfonyl hydroxamate analogue, 11
MW:     479.589620 g/mol MF: C23H33N3O6S
IUPAC name: tert-butyl 4-[[4-[but-2-ynyl(methyl)amino]phenyl]sulfonylmet...
Create Date: 2008-07-30
CID: 24860420

5497. CHEMBL369935; BDBM22429; 4-hydroxytamoxifen (4-OHT) analog, 9 ...
MW:     447.632120 g/mol MF: C28H33NO2S
IUPAC name: 4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]-5-methylsulfany...
Create Date: 2008-07-07
CID: 24825448

5498. CHEMBL202615; BDBM22428; 4-hydroxytamoxifen (4-OHT) analog, 8 ...
MW:     442.552700 g/mol MF: C27H30N4O2
IUPAC name: 4-[(Z)-5-azido-1-[4-[2-(dimethylamino)ethoxy]phenyl]-2-pheny...
Create Date: 2008-07-07
CID: 24825447

5499. CHEMBL203472; BDBM22427; 4-hydroxytamoxifen (4-OHT) analog, 7 ...
MW:     428.526120 g/mol MF: C26H28N4O2
IUPAC name: 4-[(Z)-4-azido-1-[4-[2-(dimethylamino)ethoxy]phenyl]-2-pheny...
Create Date: 2008-07-07
CID: 24825446

5500. CHEMBL204697; BDBM22426; 4-hydroxytamoxifen (4-OHT) analog, 6 ...
MW:     426.550000 g/mol MF: C28H30N2O2
IUPAC name: (Z)-6-[4-[2-(dimethylamino)ethoxy]phenyl]-6-(4-hydroxyphenyl...
Create Date: 2008-07-07
CID: 24825445

5501. CHEMBL204970; BDBM22425; 4-hydroxytamoxifen (4-OHT) analog, 5 ...
MW:     412.523420 g/mol MF: C27H28N2O2
IUPAC name: (Z)-5-[4-[2-(dimethylamino)ethoxy]phenyl]-5-(4-hydroxyphenyl...
Create Date: 2008-07-07
CID: 24825444

5502. CHEMBL383112; BDBM22424; 4-hydroxytamoxifen (4-OHT) analog, 4 ...
MW:     435.985600 g/mol MF: C27H30ClNO2
IUPAC name: 4-[(Z)-5-chloro-1-[4-[2-(dimethylamino)ethoxy]phenyl]-2-phen...
Create Date: 2008-07-07
CID: 24825443

5503. CHEMBL252134; BDBM20680; Pyrrolo[3,2-d]pyrimidine analogue, 8 ...
MW:     288.732220 g/mol MF: C14H13ClN4O
IUPAC name: 2-amino-5-[(4-chlorophenyl)methyl]-6-methyl-1H-pyrrolo[3,2-d...
Create Date: 2008-03-24
CID: 24754909

5504. CHEMBL252133; BDBM20678; Pyrrolo[3,2-d]pyrimidine analogue, 6 ...
MW:     255.275220 g/mol MF: C13H13N5O
IUPAC name: 2-amino-6-methyl-5-(pyridin-4-ylmethyl)-1H-pyrrolo[3,2-d]pyr...
Create Date: 2008-03-24
CID: 24754835

5505. CHEMBL252338; BDBM20681; Pyrrolo[3,2-d]pyrimidine analogue, 9 ...
MW:     333.183220 g/mol MF: C14H13BrN4O
IUPAC name: 2-amino-5-[(4-bromophenyl)methyl]-6-methyl-1H-pyrrolo[3,2-d]...
Create Date: 2008-03-24
CID: 24754676

5506. CHEMBL446714; BDBM20679; Pyrrolo[3,2-d]pyrimidine analogue, 7 ...
MW:     272.277623 g/mol MF: C14H13FN4O
IUPAC name: 2-amino-5-[(4-fluorophenyl)methyl]-6-methyl-1H-pyrrolo[3,2-d...
Create Date: 2008-03-24
CID: 24754675

5507. CHEMBL400304; BDBM20677; Pyrrolo[3,2-d]pyrimidine analogue, 5 ...
MW:     254.287160 g/mol MF: C14H14N4O
IUPAC name: 2-amino-5-benzyl-6-methyl-1H-pyrrolo[3,2-d]pyrimidin-4-one
Create Date: 2008-03-24
CID: 24754609

5508. CHEMBL252132; BDBM20676; Pyrrolo[3,2-d]pyrimidine analogue, 4 ...
MW:     427.410640 g/mol MF: C20H21N5O6
IUPAC name: (2S)-2-[[4-[(2-amino-6-methyl-4-oxo-1H-pyrrolo[3,2-d]pyrimid...
Create Date: 2008-03-03
CID: 24742034

5509. 64Cu]DO3A-PNA-peptide; 64Cu-WT4348; [64Cu]DO3A-CCND1 PNA-IGF1 analog ...
MW:    4411.850640 g/mol MF: C172H236CuN74O59S2
Create Date: 2008-01-23
CID: 23653496

5510. SCHEMBL17081805; BDBM19158; chlamydocin-bromomethylketone analog, 4 ...
MW:     577.510480 g/mol MF: C27H37BrN4O5
IUPAC name: (3S,9S,12R)-3-benzyl-9-(7-bromo-6-oxoheptyl)-6,6-dimethyl-1,...
Create Date: 2008-01-19
CID: 23648190

5511. 4-{5-[(1z)-1-(2-Imino-4-Oxo-1,3-Thiazolidin-5-Ylidene)ethyl]-2-Furyl}benzenesulfonamide; 2uzn; CHEMBL231950 ...
MW:     363.411420 g/mol MF: C15H13N3O4S2
IUPAC name: 4-[5-[(1Z)-1-(2-amino-4-oxo-1,3-thiazol-5-ylidene)ethyl]fura...
Create Date: 2008-01-19
CID: 23647659

5512. CHEMBL396614; BDBM17150; 2-imino-thiazolidin-4-one analog, 12 ...
MW:     383.829900 g/mol MF: C14H10ClN3O4S2
IUPAC name: 4-[5-[(Z)-(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]furan-...
Create Date: 2008-01-19
CID: 23647658

5513. 2uzl; CHEMBL233970; BDBM17149 ...
MW:     417.382810 g/mol MF: C15H10F3N3O4S2
IUPAC name: 4-[5-[(Z)-(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]furan-...
Create Date: 2008-01-19
CID: 23647657

5514. CHEMBL233765; BDBM17148; 2-imino-thiazolidin-4-one analog, 10 ...
MW:     313.331140 g/mol MF: C15H11N3O3S
IUPAC name: 4-[5-[(Z)-(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]furan-...
Create Date: 2008-01-19
CID: 23647656

5515. CHEMBL370228; BDBM16126; Biphenyl-4-ylcarbamoyl Furan Analog 17 ...
MW:     355.316563 g/mol MF: C19H14FNO5
IUPAC name: 4-[[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl]furan-3-car...
Create Date: 2008-01-19
CID: 23647309

5516. CHEMBL200895; BDBM16125; Biphenyl-4-ylcarbamoyl Furan Analog 16 ...
MW:     387.333606 g/mol MF: C20H15F2NO5
IUPAC name: 4-[[4-(3-ethoxyphenyl)-2,6-difluorophenyl]carbamoyl]furan-3-...
Create Date: 2008-01-19
CID: 23647308

5517. CHEMBL1189886; BDBM11693; Ganstigmine (CHF-2819) Analogue 10 ...
MW:     381.468080 g/mol MF: C22H27N3O3
IUPAC name: [(3aS,8bS)-3,4,8b-trimethyl-3-oxido-2,3a-dihydro-1H-pyrrolo[...
Create Date: 2008-01-19
CID: 23645752

5518. CHEMBL312726; BDBM10140; trisubstituted naphthostyril analogue 4f ...
MW:     309.337543 g/mol MF: C18H16FN3O
IUPAC name: 5-(3-aminopropyl)-6-fluoro-3-(1H-pyrrol-2-yl)-1H-benzo[cd]in...
Create Date: 2008-01-19
CID: 23645090

5519. CHEMBL415471; BDBM10139; trisubstituted naphthostyril analogue 4e ...
MW:     305.305783 g/mol MF: C18H12FN3O
IUPAC name: 3-[6-fluoro-2-oxo-3-(1H-pyrrol-2-yl)-1H-benzo[cd]indol-5-yl]...
Create Date: 2008-01-19
CID: 23645089

5520. CHEMBL83443; BDBM10138; trisubstituted naphthostyril analogue 4d ...
MW:     308.349483 g/mol MF: C19H17FN2O
IUPAC name: 6-fluoro-5-(2-methylpropyl)-3-(1H-pyrrol-2-yl)-1H-benzo[cd]i...
Create Date: 2008-01-19
CID: 23645088

5521. BDBM10130; trisubstituted naphthostyril analogue 8c; 9-fluoro-5-(1H-pyrrol-2-yl)-7-[(2R)-pyrrolidin-2-ylsulfanyl]-2-azatricyclo[6.3.1.0;{4,12}]dodeca-1(11),4,6,8(12),9-pentaen-3-one
MW:     353.413243 g/mol MF: C19H16FN3OS
IUPAC name: 6-fluoro-5-[(2R)-pyrrolidin-2-yl]sulfanyl-3-(1H-pyrrol-2-yl)...
Create Date: 2008-01-19
CID: 23645087

5522. CHEMBL84284; BDBM10127; trisubstituted naphthostyril analogue 7g
MW:     410.441423 g/mol MF: C22H23FN4O3
IUPAC name: tert-butyl N-[2-[[6-fluoro-2-oxo-3-(1H-pyrrol-2-yl)-1H-benzo...
Create Date: 2008-01-19
CID: 23645086

5523. CHEMBL82020; BDBM10120; trisubstituted naphthostyril analogue 6f ...
MW:     368.358383 g/mol MF: C20H17FN2O4
IUPAC name: 3-[[6-fluoro-2-oxo-3-(1H-pyrrol-2-yl)-1H-benzo[cd]indol-5-yl...
Create Date: 2008-01-19
CID: 23645085

5524. BDBM9970; CHEMBL308537; 6-Substituted Androst-4-ene Analog 5c ...
MW:     302.451000 g/mol MF: C20H30O2
IUPAC name: (6R)-6-methoxy-10,13-dimethyl-1,2,3,6,7,8,9,11,12,14,15,16-d...
Create Date: 2008-01-19
CID: 23644997

5525. BDBM9969; CHEMBL304770; 6-Substituted Androst-4-ene Analog 5b ...
MW:     330.461100 g/mol MF: C21H30O3
IUPAC name: [(6R)-10,13-dimethyl-17-oxo-1,2,3,6,7,8,9,11,12,14,15,16-dod...
Create Date: 2008-01-19
CID: 23644996

5526. CHEMBL73993; BDBM9968; 6-Substituted Androst-4-ene Analog 5a ...
MW:     288.424420 g/mol MF: C19H28O2
IUPAC name: (6R)-6-hydroxy-10,13-dimethyl-1,2,3,6,7,8,9,11,12,14,15,16-d...
Create Date: 2008-01-19
CID: 23644995

5527. BDBM9967; CHEMBL307581; 6-Substituted Androst-4-ene Analog 4c ...
MW:     302.451000 g/mol MF: C20H30O2
IUPAC name: (6S)-6-methoxy-10,13-dimethyl-1,2,3,6,7,8,9,11,12,14,15,16-d...
Create Date: 2008-01-19
CID: 23644994

5528. CHEMBL72228; BDBM9966; 6-Substituted Androst-4-ene Analog 4b ...
MW:     330.461100 g/mol MF: C21H30O3
IUPAC name: [(6S)-10,13-dimethyl-17-oxo-1,2,3,6,7,8,9,11,12,14,15,16-dod...
Create Date: 2008-01-19
CID: 23644993

5529. BDBM9965; CHEMBL307643; 6-Substituted Androst-4-ene Analog 4a ...
MW:     288.424420 g/mol MF: C19H28O2
IUPAC name: (6S)-6-hydroxy-10,13-dimethyl-1,2,3,6,7,8,9,11,12,14,15,16-d...
Create Date: 2008-01-19
CID: 23644992

5530. CHEMBL235559; BDBM23511; beta-sulfonyl hydroxamate analogue, 22 ...
MW:     435.537060 g/mol MF: C21H29N3O5S
IUPAC name: 4-[[4-(but-2-ynylamino)phenyl]sulfonylmethyl]-N-hydroxy-1-(2...
Create Date: 2007-12-17
CID: 23625454

5531. QTVCZKXTTIXGRA-UHFFFAOYSA-N; Fentanyl ortho methylphenyl acetyl analog; 1-[2-(2-methylphenyl)ethyl]-4-(N-acetanilido)piperidine
MW:     336.470520 g/mol MF: C22H28N2O
IUPAC name: N-[1-[2-(2-methylphenyl)ethyl]piperidin-4-yl]-N-phenylacetam...
Create Date: 2007-12-05
CID: 22294993

5532. Gendenafil; 147676-66-2; 5-(5-Acetyl-2-ethoxyphenyl)-1,6-dihydro-1-Methyl-3-propyl-7H-pyrazolo(4,3-d)pyriMidin-7-one ...
MW:     354.402980 g/mol MF: C19H22N4O3
IUPAC name: 5-(5-acetyl-2-ethoxyphenyl)-1-methyl-3-propyl-4H-pyrazolo[4,...
Create Date: 2007-12-05
CID: 21250674

5533. BDBM18252; Pyrrolo[2, 3-d]pyrimidine analogue, 9; 6-[(3,4-dichlorophenyl)sulfanyl]-5-ethyl-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine
MW:     354.257520 g/mol MF: C14H13Cl2N5S
IUPAC name: 6-(3,4-dichlorophenyl)sulfanyl-5-ethyl-7H-pyrrolo[2,3-d]pyri...
Create Date: 2007-09-17
CID: 16733032

5534. GP41 RESIDUES 556-590; GP41 (553-590) ANALOG; Ac-CGGIEAQQHLLQLTVWGIKQLQARILAVERYLKDQ CONH2
MW:    4060.723500 g/mol MF: C183H300N52O50S
Create Date: 2007-07-06
CID: 16197381

5535. BDBM50087727; Glucagon like peptide-1(GLP-1)analogue
MW:    3494.860740 g/mol MF: C159H241N41O48
Create Date: 2007-07-04
CID: 16136660

5536. BDBM92616; Difluoroketone phospholipid analogue, 4
MW:     543.621688 g/mol MF: C25H48F2NO7P
IUPAC name: [5,5-difluoro-2-(octanoyloxymethyl)-4-oxoundecyl] 2-(trimeth...
Create Date: 2007-02-08
CID: 13962350

5537. BDBM92615; Difluoroketone phospholipid analogue, 3
MW:     655.877388 g/mol MF: C34H68F2NO6P
IUPAC name: [3,3-difluoro-2-(octoxymethyl)-4-oxoicosyl] 2-(trimethylazan...
Create Date: 2007-02-08
CID: 13962334

5538. BDBM92614; Difluoroketone phospholipid analogue, 2
MW:     529.638168 g/mol MF: C25H50F2NO6P
IUPAC name: [3,3-difluoro-2-(octoxymethyl)-4-oxoundecyl] 2-(trimethylaza...
Create Date: 2007-02-08
CID: 13962327

5539. BDBM92613; Difluoroketone phospholipid analogue, 1
MW:     387.399548 g/mol MF: C16H32F2NO5P
IUPAC name: (3,3-difluoro-4-oxoundecyl) 2-(trimethylazaniumyl)ethyl phos...
Create Date: 2007-02-08
CID: 13962313

5540. 5-(5-acetyl-2-propoxy-3-pyridinyl)-3-ethyl-2-(1-ethyl-3-azetidinyl)-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one; CHEMBL210533; SCHEMBL2029805 ...
MW:     424.496120 g/mol MF: C22H28N6O3
IUPAC name: 5-(5-acetyl-2-propoxypyridin-3-yl)-3-ethyl-2-(1-ethylazetidi...
Create Date: 2006-10-26
CID: 11718790

5541. CHEMBL371666; BDBM18802; Pyrrolo[2,3-d]pyrimidine analogue, 9 ...
MW:     365.248220 g/mol MF: C14H13BrN4OS
IUPAC name: 2-amino-5-(4-bromophenyl)sulfanyl-6-ethyl-1,7-dihydropyrrolo...
Create Date: 2006-10-26
CID: 11717559

5542. BDBM9684; CHEMBL207906; SCH446211 (SCH6) Analog 17 ...
MW:     742.901920 g/mol MF: C38H58N6O9
IUPAC name: 2-methylpropyl N-[(2S)-1-[(3aR,4S,6aR)-4-[[1-[[2-[[(1S)-2-(d...
Create Date: 2006-10-26
CID: 11707547

5543. BDBM9687; CHEMBL206650; SCH446211 (SCH6) Analog 20 ...
MW:     712.875940 g/mol MF: C37H56N6O8
IUPAC name: 2-methylpropyl N-[(2S)-1-[(1R,2S,5S)-2-[[1-[[2-[[(1S)-2-(dim...
Create Date: 2006-10-26
CID: 11686296

5544. CHEMBL379222; SCHEMBL2033869; BDBM14404 ...
MW:     438.522700 g/mol MF: C23H30N6O3
IUPAC name: 5-(5-acetyl-2-propoxypyridin-3-yl)-3-ethyl-2-(1-methylpiperi...
Create Date: 2006-10-26
CID: 11683591

5545. CHEMBL211015; SCHEMBL2032658; BDBM14403 ...
MW:     424.496120 g/mol MF: C22H28N6O3
IUPAC name: 5-(5-acetyl-2-propoxypyridin-3-yl)-3-ethyl-2-piperidin-4-yl-...
Create Date: 2006-10-26
CID: 11683277

5546. CHEMBL383202; SCHEMBL2034968; BDBM14408 ...
MW:     449.505580 g/mol MF: C23H27N7O3
IUPAC name: 5-(5-acetyl-2-butoxypyridin-3-yl)-3-ethyl-2-[(1-methylimidaz...
Create Date: 2006-10-26
CID: 11676752

5547. CHEMBL436742; SCHEMBL2034513; BDBM14398 ...
MW:     435.479000 g/mol MF: C22H25N7O3
IUPAC name: 5-(5-acetyl-2-propoxypyridin-3-yl)-3-ethyl-2-[(1-methylimida...
Create Date: 2006-10-26
CID: 11662039

5548. CHEMBL201617; BDBM18800; Pyrrolo[2,3-d]pyrimidine analogue, 6 ...
MW:     331.349720 g/mol MF: C14H13N5O3S
IUPAC name: 2-amino-6-ethyl-5-(4-nitrophenyl)sulfanyl-1,7-dihydropyrrolo...
Create Date: 2006-10-26
CID: 11659960

5549. BDBM9683; CHEMBL380935; SCHEMBL10139496 ...
MW:     744.917800 g/mol MF: C38H60N6O9
IUPAC name: 2-methylpropyl N-[(2S)-1-[(2S,4R)-2-[[1-[[2-[[(1S)-2-(dimeth...
Create Date: 2006-10-26
CID: 11650652

5550. CHEMBL378737; SCHEMBL2029414; BDBM14416 ...
MW:     424.496120 g/mol MF: C22H28N6O3
IUPAC name: 5-(5-acetyl-2-propoxypyridin-3-yl)-2-(1-methylazetidin-3-yl)...
Create Date: 2006-10-26
CID: 11640435

5551. 5-(5-acetyl-2-butoxy-3-pyridinyl)-3-ethyl-2-(4-piperidinyl)-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one; CHEMBL207125; SCHEMBL2034918 ...
MW:     438.522700 g/mol MF: C23H30N6O3
IUPAC name: 5-(5-acetyl-2-butoxypyridin-3-yl)-3-ethyl-2-piperidin-4-yl-4...
Create Date: 2006-10-26
CID: 11633532

5552. BDBM9685; CHEMBL380516; SCH446211 (SCH6) Analog 18 ...
MW:     740.929100 g/mol MF: C39H60N6O8
IUPAC name: 2-methylpropyl N-[(2S)-1-[(3S,3aS,6aR)-3-[[1-[[2-[[(1S)-2-(d...
Create Date: 2006-10-26
CID: 11578563

5553. CHEMBL207111; SCHEMBL2029327; BDBM14409 ...
MW:     410.469540 g/mol MF: C21H26N6O3
IUPAC name: 5-(5-acetyl-2-butoxypyridin-3-yl)-2-(azetidin-3-yl)-3-ethyl-...
Create Date: 2006-10-26
CID: 11575118

5554. CHEMBL377579; SCHEMBL2032275; BDBM14400 ...
MW:     410.469540 g/mol MF: C21H26N6O3
IUPAC name: 5-(5-acetyl-2-propoxypyridin-3-yl)-3-ethyl-2-(1-methylazetid...
Create Date: 2006-10-26
CID: 11575117

5555. BDBM9678; SCHEMBL10137445; SCH446211 (SCH6) Analog 11 ...
MW:     700.865240 g/mol MF: C36H56N6O8
IUPAC name: 2-methylpropyl N-[(2S)-1-[(2S)-2-[[(3S)-1-[[2-[[(1S)-2-(dime...
Create Date: 2006-10-26
CID: 11571184

5556. CHEMBL377885; SCHEMBL2032603; BDBM14405 ...
MW:     452.549280 g/mol MF: C24H32N6O3
IUPAC name: 5-(5-acetyl-2-propoxypyridin-3-yl)-3-ethyl-2-(1-ethylpiperid...
Create Date: 2006-10-26
CID: 11561521

5557. CHEMBL208544; SCHEMBL2029530; BDBM14410 ...
MW:     424.496120 g/mol MF: C22H28N6O3
IUPAC name: 5-(5-acetyl-2-butoxypyridin-3-yl)-3-ethyl-2-(1-methylazetidi...
Create Date: 2006-10-26
CID: 11560908

5558. CHEMBL201941; BDBM18799; Pyrrolo[2,3-d]pyrimidine analogue, 5 ...
MW:     355.242280 g/mol MF: C14H12Cl2N4OS
IUPAC name: 2-amino-5-(3,4-dichlorophenyl)sulfanyl-6-ethyl-1,7-dihydropy...
Create Date: 2006-10-26
CID: 11552140

5559. BDBM9682; SCH446211 (SCH6) Analog 15; 2-methylpropyl N-[(1S)-2-[(2S,4R)-4-(tert-butylsulfanyl)-2-({1-[({[(S)-(dimethylcarbamoyl)(phenyl)methyl]carbamoyl}methyl)carbamoyl]-1-oxopentan-2-yl}carbamoyl)pyrrolidin-1-yl]-1-cyclohexyl-2-oxoethyl]carbamate ...
MW:     787.020680 g/mol MF: C40H62N6O8S
IUPAC name: 2-methylpropyl N-[(1S)-2-[(2S,4R)-4-tert-butylsulfanyl-2-[[1...
Create Date: 2006-10-26
CID: 11549564

5560. BDBM9677; CHEMBL208207; SCH446211 (SCH6) Analog 10 ...
MW:     686.838660 g/mol MF: C35H54N6O8
IUPAC name: 2-methylpropyl N-[(2S)-1-[(2S,4R)-2-[[1-[[2-[[(1S)-2-(dimeth...
Create Date: 2006-10-26
CID: 11542098

5561. 5-(5-acetyl-2-propoxy-3-pyridinyl)-2-(3-azetidinyl)-3-ethyl-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one; CHEMBL209062; SCHEMBL2028137 ...
MW:     396.442960 g/mol MF: C20H24N6O3
IUPAC name: 5-(5-acetyl-2-propoxypyridin-3-yl)-2-(azetidin-3-yl)-3-ethyl...
Create Date: 2006-10-26
CID: 11538505

5562. CHEMBL370116; BDBM18809; Pyrrolo[2,3-d]pyrimidine analogue, 8 ...
MW:     320.797220 g/mol MF: C14H13ClN4OS
IUPAC name: 2-amino-5-(4-chlorophenyl)sulfanyl-6-ethyl-1,7-dihydropyrrol...
Create Date: 2006-10-26
CID: 11537068

5563. BDBM9680; CHEMBL378158; SCH446211 (SCH6) Analog 13 ...
MW:     789.016640 g/mol MF: C38H56N6O8S2
IUPAC name: 2-methylpropyl N-[(1S)-1-cyclohexyl-2-[(8S)-8-[[1-[[2-[[(1S)...
Create Date: 2006-10-26
CID: 11535122

5564. BDBM9688; CHEMBL380802; SCHEMBL10226759 ...
MW:     712.875940 g/mol MF: C37H56N6O8
IUPAC name: tert-butyl N-[(2S)-1-[(1R,2S,5S)-2-[[1-[[2-[[(1S)-2-(dimethy...
Create Date: 2006-10-26
CID: 11527732

5565. BDBM9679; CHEMBL380934; SCHEMBL14597342 ...
MW:     752.939800 g/mol MF: C40H60N6O8
IUPAC name: 2-methylpropyl N-[(1S)-1-cyclohexyl-2-[(3S)-3-[[1-[[2-[[(1S)...
Create Date: 2006-10-26
CID: 11520565

5566. CHEMBL209235; SCHEMBL2038018; BDBM14406 ...
MW:     424.496120 g/mol MF: C22H28N6O3
IUPAC name: 5-[5-acetyl-2-(2-methylpropoxy)pyridin-3-yl]-3-ethyl-2-(1-me...
Create Date: 2006-10-26
CID: 11517466

5567. CHEMBL209509; SCHEMBL2033296; BDBM14415 ...
MW:     410.469540 g/mol MF: C21H26N6O3
IUPAC name: 5-(5-acetyl-2-propoxypyridin-3-yl)-2-(azetidin-3-yl)-3-propy...
Create Date: 2006-10-26
CID: 11517138

5568. CHEMBL427043; SCHEMBL2032524; BDBM14413 ...
MW:     466.575860 g/mol MF: C25H34N6O3
IUPAC name: 5-(5-acetyl-2-butoxypyridin-3-yl)-3-ethyl-2-(1-ethylpiperidi...
Create Date: 2006-10-26
CID: 11511048

5569. CHEMBL200301; SCHEMBL6185946; BDBM19858 ...
MW:     370.445440 g/mol MF: C20H26N4O3
IUPAC name: N-[1-(cyanomethylcarbamoyl)cyclohexyl]-4-morpholin-4-ylbenza...
Create Date: 2006-10-26
CID: 11501571

5570. CHEMBL381723; BDBM18801; Pyrrolo[2,3-d]pyrimidine analogue, 7 ...
MW:     304.342623 g/mol MF: C14H13FN4OS
IUPAC name: 2-amino-6-ethyl-5-(4-fluorophenyl)sulfanyl-1,7-dihydropyrrol...
Create Date: 2006-10-26
CID: 11500463

5571. BDBM9686; CHEMBL206271; SCHEMBL14450701 ...
MW:     738.913220 g/mol MF: C39H58N6O8
IUPAC name: 2-methylpropyl N-[(1S)-1-cyclohexyl-2-[(1R,2S,5S)-2-[[1-[[2-...
Create Date: 2006-10-26
CID: 11498649

5572. CHEMBL441684; SCHEMBL2030344; BDBM14414 ...
MW:     470.521500 g/mol MF: C23H30N6O5
IUPAC name: 5-[5-acetyl-2-(2-methoxyethoxy)pyridin-3-yl]-3-ethyl-2-(2-mo...
Create Date: 2006-10-26
CID: 11496485

5573. AJSIYPSFUJBPMF-UHFFFAOYSA-N; Oxydemeton-methyl M (probably O-analog)
MW:     230.219062 g/mol MF: C6H15O5PS
IUPAC name: 2-ethylsulfinylethyl dimethyl phosphate
Create Date: 2006-10-26
CID: 10998800

5574. CHEMBL400364; BDBM18807; Pyrrolo[2,3-d]pyrimidine analogue, 2 ...
MW:     317.323140 g/mol MF: C13H11N5O3S
IUPAC name: 2-amino-6-methyl-5-(4-nitrophenyl)sulfanyl-1,7-dihydropyrrol...
Create Date: 2006-10-25
CID: 10471067

5575. BDBM9681; CHEMBL208305; SCH446211 (SCH6) Analog 14 ...
MW:     803.043220 g/mol MF: C39H58N6O8S2
IUPAC name: 2-methylpropyl N-[(1S)-1-cyclohexyl-2-[(3S)-3-[[1-[[2-[[(1S)...
Create Date: 2006-10-25
CID: 10463061

5576. BDBM9689; CHEMBL377179; SCHEMBL14450642 ...
MW:     726.902520 g/mol MF: C38H58N6O8
IUPAC name: tert-butyl N-[(2S)-1-[(1R,2S,5S)-2-[[1-[[2-[[(1S)-2-(dimethy...
Create Date: 2006-10-25
CID: 10462630

5577. CHEMBL371860; BDBM18798; Pyrrolo[2,3-d]pyrimidine analogue, 4 ...
MW:     459.475640 g/mol MF: C20H21N5O6S
IUPAC name: (2S)-2-[[4-[(2-amino-6-ethyl-4-oxo-1,7-dihydropyrrolo[2,3-d]...
Create Date: 2006-10-25
CID: 10366939

5578. CHEMBL84347; SCHEMBL6587491; BDBM10125 ...
MW:     366.431923 g/mol MF: C21H23FN4O
IUPAC name: 5-[2-(diethylamino)ethylamino]-6-fluoro-3-(1H-pyrrol-2-yl)-1...
Create Date: 2006-10-25
CID: 10270270

5579. CHEMBL82768; SCHEMBL6588419; BDBM10124 ...
MW:     338.378763 g/mol MF: C19H19FN4O
IUPAC name: 5-[(2-amino-2-methylpropyl)amino]-6-fluoro-3-(1H-pyrrol-2-yl...
Create Date: 2006-10-25
CID: 10268741

5580. CHEMBL79848; SCHEMBL6590012; BDBM10117 ...
MW:     312.295123 g/mol MF: C17H13FN2O3
IUPAC name: 6-fluoro-5-(2-hydroxyethoxy)-3-(1H-pyrrol-2-yl)-1H-benzo[cd]...
Create Date: 2006-10-25
CID: 10267663

5581. SCHEMBL119755; CHEMBL208583; BDBM14402 ...
MW:     438.522700 g/mol MF: C23H30N6O3
IUPAC name: 5-(5-acetyl-2-propoxypyridin-3-yl)-3-ethyl-2-(1-propan-2-yla...
Create Date: 2006-10-25
CID: 10225142

5582. CHEMBL81196; SCHEMBL6589879; BDBM10123 ...
MW:     324.352183 g/mol MF: C18H17FN4O
IUPAC name: 5-(3-aminopropylamino)-6-fluoro-3-(1H-pyrrol-2-yl)-1H-benzo[...
Create Date: 2006-10-25
CID: 10221609

5583. CHEMBL199358; SCHEMBL6183543; BDBM19857 ...
MW:     453.557180 g/mol MF: C23H27N5O3S
IUPAC name: N-[1-(cyanomethylcarbamoyl)cyclohexyl]-4-(2-morpholin-4-yl-1...
Create Date: 2006-10-25
CID: 10161284

5584. CHEMBL401674; SCHEMBL4865792; BDBM25993 ...
MW:     431.914080 g/mol MF: C25H22ClN3O2
IUPAC name: N-[(4-chlorophenyl)methyl]-N-methyl-4-[2-methyl-5-(5-methyl-...
Create Date: 2006-10-25
CID: 10159882

5585. CHEMBL267281; SCHEMBL4861206; BDBM25994 ...
MW:     408.451900 g/mol MF: C25H20N4O2
IUPAC name: N-(3-cyanophenyl)-N-methyl-4-[2-methyl-5-(5-methyl-1,3,4-oxa...
Create Date: 2006-10-25
CID: 10158364

5586. CHEMBL312273; SCHEMBL6587505; BDBM10126 ...
MW:     352.362283 g/mol MF: C19H17FN4O2
IUPAC name: N-[2-[[6-fluoro-2-oxo-3-(1H-pyrrol-2-yl)-1H-benzo[cd]indol-5...
Create Date: 2006-10-25
CID: 10132679

5587. BDBM9690; CHEMBL208138; SCHEMBL13224178 ...
MW:     766.847330 g/mol MF: C37H53F3N6O8
IUPAC name: tert-butyl N-[(2S)-1-[(1R,2S,5S)-2-[[1-[[2-[[(1S)-2-(dimethy...
Create Date: 2006-10-25
CID: 10101685

5588. CHEMBL79498; SCHEMBL6588070; BDBM10131 ...
MW:     353.413243 g/mol MF: C19H16FN3OS
IUPAC name: 6-fluoro-5-[(3S)-pyrrolidin-3-yl]sulfanyl-3-(1H-pyrrol-2-yl)...
Create Date: 2006-10-25
CID: 10066656

5589. CHEMBL400485; BDBM18808; Pyrrolo[2,3-d]pyrimidine analogue, 3 ...
MW:     341.215700 g/mol MF: C13H10Cl2N4OS
IUPAC name: 2-amino-5-(3,4-dichlorophenyl)sulfanyl-6-methyl-1,7-dihydrop...
Create Date: 2006-10-25
CID: 10065888

5590. CHEMBL63033; SCHEMBL7343548; BDBM50064652 ...
MW:     374.480500 g/mol MF: C19H30N6O2
IUPAC name: (2S)-1-[(2R)-2-amino-3-phenylpropanoyl]-N-[4-(diaminomethyli...
Create Date: 2006-10-25
CID: 10022303

5591. CHEMBL83369; SCHEMBL6587397; BDBM10128 ...
MW:     328.360723 g/mol MF: C17H13FN2O2S
IUPAC name: 6-fluoro-5-(2-hydroxyethylsulfanyl)-3-(1H-pyrrol-2-yl)-1H-be...
Create Date: 2006-10-25
CID: 9967203

5592. CHEMBL82251; SCHEMBL6590493; BDBM10137 ...
MW:     280.296323 g/mol MF: C17H13FN2O
IUPAC name: 5-ethyl-6-fluoro-3-(1H-pyrrol-2-yl)-1H-benzo[cd]indol-2-one
Create Date: 2006-10-25
CID: 9965506

5593. CHEMBL79356; SCHEMBL6589342; BDBM10132 ...
MW:     343.375363 g/mol MF: C17H14FN3O2S
IUPAC name: 5-(2-aminoethylsulfinyl)-6-fluoro-3-(1H-pyrrol-2-yl)-1H-benz...
Create Date: 2006-10-25
CID: 9946036

5594. CHEMBL83499; SCHEMBL6588472; BDBM10121 ...
MW:     311.310363 g/mol MF: C17H14FN3O2
IUPAC name: 6-fluoro-5-(2-hydroxyethylamino)-3-(1H-pyrrol-2-yl)-1H-benzo...
Create Date: 2006-10-25
CID: 9944548

5595. 5-(5-acetyl-2-butoxy-3-pyridinyl)-3-ethyl-2-(1-methyl-4-piperidinyl)-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one; CHEMBL382440; SCHEMBL2033129 ...
MW:     452.549280 g/mol MF: C24H32N6O3
IUPAC name: 5-(5-acetyl-2-butoxypyridin-3-yl)-3-ethyl-2-(1-methylpiperid...
Create Date: 2006-10-25
CID: 9933588

5596. CHEMBL310755; SCHEMBL6588611; BDBM10116 ...
MW:     296.295723 g/mol MF: C17H13FN2O2
IUPAC name: 5-ethoxy-6-fluoro-3-(1H-pyrrol-2-yl)-1H-benzo[cd]indol-2-one
Create Date: 2006-10-25
CID: 9922207

5597. CHEMBL83775; SCHEMBL6588801; BDBM10115 ...
MW:     282.269143 g/mol MF: C16H11FN2O2
IUPAC name: 6-fluoro-5-methoxy-3-(1H-pyrrol-2-yl)-1H-benzo[cd]indol-2-on...
Create Date: 2006-10-25
CID: 9921823

5598. CHEMBL82603; SCHEMBL6589000; BDBM10136 ...
MW:     266.269743 g/mol MF: C16H11FN2O
IUPAC name: 6-fluoro-5-methyl-3-(1H-pyrrol-2-yl)-1H-benzo[cd]indol-2-one
Create Date: 2006-10-25
CID: 9921498

5599. CHEMBL311464; SCHEMBL6589205; BDBM10129 ...
MW:     327.375963 g/mol MF: C17H14FN3OS
IUPAC name: 5-(2-aminoethylsulfanyl)-6-fluoro-3-(1H-pyrrol-2-yl)-1H-benz...
Create Date: 2006-10-25
CID: 9858586

5600. CHEMBL79364; SCHEMBL6590368; BDBM10119 ...
MW:     326.321703 g/mol MF: C18H15FN2O3
IUPAC name: 6-fluoro-5-(3-hydroxypropoxy)-3-(1H-pyrrol-2-yl)-1H-benzo[cd...
Create Date: 2006-10-25
CID: 9858505

5601. CHEMBL312018; SCHEMBL6588351; BDBM10135 ...
MW:     252.243163 g/mol MF: C15H9FN2O
IUPAC name: 6-fluoro-3-(1H-pyrrol-2-yl)-1H-benzo[cd]indol-2-one
Create Date: 2006-10-25
CID: 9837883

5602. CHEMBL311992; SCHEMBL6590171; BDBM10118 ...
MW:     311.310363 g/mol MF: C17H14FN3O2
IUPAC name: 5-(2-aminoethoxy)-6-fluoro-3-(1H-pyrrol-2-yl)-1H-benzo[cd]in...
Create Date: 2006-10-25
CID: 9836341

5603. CHEMBL378130; SCHEMBL2033108; BDBM14407 ...
MW:     468.548680 g/mol MF: C24H32N6O4
IUPAC name: 5-(5-acetyl-2-butoxypyridin-3-yl)-3-ethyl-2-(2-morpholin-4-y...
Create Date: 2006-10-25
CID: 9825874

5604. UNII-UOR82EXA9D; UOR82EXA9D; Morpholinoacetildenafil ...
MW:     439.507460 g/mol MF: C23H29N5O4
IUPAC name: 5-[2-ethoxy-5-(2-morpholin-4-ylacetyl)phenyl]-1-methyl-3-pro...
Create Date: 2006-10-25
CID: 9824474

5605. SCHEMBL549163; 2,2,2-Trichloroethyl carbamate analog; 2,2,2-trichloroethyl (NZ)-N-[amino-[4-[5-[4-[(Z)-N'-(2,2,2-trichloroethoxycarbonyl)carbamimidoyl]phenyl]-2-furyl]phenyl]methylene]carbamate ...
MW:     655.141520 g/mol MF: C24H18Cl6N4O5
IUPAC name: 2,2,2-trichloroethyl (NZ)-N-[amino-[4-[5-[4-[(Z)-N'-(2,2,2-t...
Create Date: 2006-10-24
CID: 9574861

5606. Ixabepilone; Azaepothilone B; 219989-84-1 ...
MW:     506.697780 g/mol MF: C27H42N2O5S
IUPAC name: (1S,3S,7S,10R,11S,12S,16R)-7,11-dihydroxy-8,8,10,12,16-penta...
Create Date: 2006-04-29
CID: 6445540

5607. SAA-11-VV-OMe; CHEMBL48491; 126333-34-4 ...
MW:     698.744602 g/mol MF: C31H51N6O10P
IUPAC name: [(1R)-1-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-hydroxypropanoyl]...
Create Date: 2005-08-01
CID: 5479165

5608. NSC361802; ELLIPTICINE ANALOG JR6-388-A; NSC-361802 ...
MW:     288.386200 g/mol MF: C20H20N2
IUPAC name: 5,11-dimethyl-3-propyl-6H-pyrido[4,3-b]carbazole
Create Date: 2005-03-26
CID: 5384784

5609. AC1MJ2HG; SODIUM METHIONINE HYDROXY ANALOG; OR044213 ...
MW:     173.185869 g/mol MF: C5H10NaO3S+
IUPAC name: sodium;2-hydroxy-4-methylsulfanylbutanoic acid
Create Date: 2005-08-09
CID: 3084406

5610. 4-Hydroxytoremifene; 110503-62-3; 4-Hydroxy Toremifene ...
MW:     421.959020 g/mol MF: C26H28ClNO2
IUPAC name: 4-[(Z)-4-chloro-1-[4-[2-(dimethylamino)ethoxy]phenyl]-2-phen...
Create Date: 2005-08-08
CID: 3035198

5611. dimethyl pyrrolo[1,2-a]quinoline-2,3-dicarboxylate; Pyrrolo[1,2-a]quinoline-2,3-dicarboxylic acid dimethyl ester; AC1MHDFG ...
MW:     283.278720 g/mol MF: C16H13NO4
IUPAC name: dimethyl pyrrolo[1,2-a]quinoline-2,3-dicarboxylate
Create Date: 2005-08-01
CID: 3000864

5612. 2-(4-methylphenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine; AC1MBO6E; Maybridge4_003496 ...
MW:     329.457960 g/mol MF: C22H19NS
IUPAC name: 2-(4-methylphenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine
Create Date: 2005-07-19
CID: 2728660

5613. 3-(Pyridin-2-ylsulfanylmethyl)-benzofuran-2-carboxylic acid; 3-[(pyridin-2-ylsulfanyl)methyl]-1-benzofuran-2-carboxylic acid; SMR000010572 ...
MW:     285.317740 g/mol MF: C15H11NO3S
IUPAC name: 3-(pyridin-2-ylsulfanylmethyl)-1-benzofuran-2-carboxylic aci...
Create Date: 2005-06-04
CID: 646827

5614. AC1LDBW0; RROIUIGBEXMCGR-UHFFFAOYSA-N; Fentanyl meta methylphenyl acetyl analog ...
MW:     336.470520 g/mol MF: C22H28N2O
IUPAC name: N-[1-[2-(3-methylphenyl)ethyl]piperidin-4-yl]-N-phenylacetam...
Create Date: 2005-03-27
CID: 615725

5615. 2,4-Diphenyl-2,3-dihydro-1,5-benzothiazepine; 1,5-Benzothiazepine, 2,3-dihydro-2,4-diphenyl-; 40358-31-4 ...
MW:     315.431380 g/mol MF: C21H17NS
IUPAC name: 2,4-diphenyl-2,3-dihydro-1,5-benzothiazepine
Create Date: 2005-03-27
CID: 611171

5616. AC1LALGN; BDBM9300; CHEMBL310924 ...
MW:     767.400060 g/mol MF: C40H59ClN8O5
IUPAC name: (3S,4aS,8aS)-N-tert-butyl-2-[(2R,3S)-3-[[(2S)-2-[[6-chloro-5...
Create Date: 2005-08-01
CID: 515894

5617. CHEMBL225180; AC1LABDF; BDBM18797 ...
MW:     445.449060 g/mol MF: C19H19N5O6S
IUPAC name: (2S)-2-[[4-[(2-amino-6-methyl-4-oxo-1,7-dihydropyrrolo[2,3-d...
Create Date: 2005-08-01
CID: 484980

5618. AC1LAK0G; Spirodihydrobenzofuranlactam imide analog; 2',4-dihydroxy-1',1',4'a,6'-tetramethyl-spiro[3H-furo[3,2-f]isoindole-2,5'-decalin]-5,7-dione ...
MW:     399.480060 g/mol MF: C23H29NO5
IUPAC name: 3,4'-dihydroxy-4,4,7,8a-tetramethylspiro[2,3,4a,5,6,7-hexahy...
Create Date: 2005-08-01
CID: 469819

5619. 1-[(5-Methanesulfonamidoindol-2-yl)carbonyl]-4-[N-ethyl-N-[6-chloro-3-[(1,1-dimethylethyl)amino]-2-pyridinyl]amino]piperidine; AC1LA7AN; BDBM2666 ...
MW:     547.112500 g/mol MF: C26H35ClN6O3S
IUPAC name: N-[2-[4-[[3-(tert-butylamino)-6-chloropyridin-2-yl]-ethylami...
Create Date: 2005-08-01
CID: 462985

5620. AC1LA7AH; BDBM2664; CHEMBL330990 ...
MW:     516.631323 g/mol MF: C25H33FN6O3S
IUPAC name: N-[2-[4-[[3-(tert-butylamino)-6-fluoropyridin-2-yl]-methylam...
Create Date: 2005-08-01
CID: 462983

5621. AC1LA3FX; CHEMBL331599; Isoquinoline furanyl urethane analog. 7
MW:     555.748560 g/mol MF: C32H49N3O5
IUPAC name: [(3R,3aR,6aS)-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-...
Create Date: 2005-08-01
CID: 461022

5622. AC1L9TC8; CHEMBL83768; Ro 31-8959, bis-Thf deriv. ...
MW:     557.721380 g/mol MF: C31H47N3O6
IUPAC name: [(3aR,4S,6aS)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ...
Create Date: 2005-08-01
CID: 455675

5623. AC1L9TC5; L 739594; CHEMBL315403 ...
MW:     557.721380 g/mol MF: C31H47N3O6
IUPAC name: [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ...
Create Date: 2005-08-01
CID: 455674

5624. CHEMBL83362; AC1L9S43; BDBM1362 ...
MW:     367.462880 g/mol MF: C24H17NOS
IUPAC name: 9b-anthracen-9-yl-2,3-dihydro-[1,3]thiazolo[2,3-a]isoindol-5...
Create Date: 2005-08-01
CID: 455083

5625. CHEMBL125510; AC1L9RNC; BDBM1286 ...
MW:     293.362960 g/mol MF: C18H19N3O
IUPAC name: 5-ethyl-6-methyl-3-(quinolin-3-ylmethylamino)-1H-pyridin-2-o...
Create Date: 2005-08-01
CID: 454441

5626. CHEMBL121835; 143707-83-9; 2(1H)-Pyridinone, 3-((benzo(b)thien-2-ylmethyl)amino)-5-ethyl-6-methyl- ...
MW:     298.402620 g/mol MF: C17H18N2OS
IUPAC name: 3-(1-benzothiophen-2-ylmethylamino)-5-ethyl-6-methyl-1H-pyri...
Create Date: 2005-08-01
CID: 454387

5627. 143707-81-7; 3-[[(4,5,6,7-Tetrahydro-2-benzoxazolyl)methyl]amino]-5-ethyl-6-methylpyridin-2(1H)-one; 3-(((4,5,6,7-Tetrahydro-2-benzoxazolyl)methyl)amino)-5-ethyl-6-methylpyridin-2(1H)-one ...
MW:     287.356840 g/mol MF: C16H21N3O2
IUPAC name: 5-ethyl-6-methyl-3-(4,5,6,7-tetrahydro-1,3-benzoxazol-2-ylme...
Create Date: 2005-08-01
CID: 454386

5628. CHEMBL318730; 135525-74-5; 3-((2-Naphthylmethyl)amino)-5-ethyl-6-methylpyridin-2(1H)-one ...
MW:     292.374900 g/mol MF: C19H20N2O
IUPAC name: 5-ethyl-6-methyl-3-(naphthalen-2-ylmethylamino)-1H-pyridin-2...
Create Date: 2005-08-01
CID: 453441

5629. CHEMBL316785; 135525-72-3; 3-[(2-Benzofuranylmethyl)amino]-5-ethyl-6-methylpyridin-2(1H)-one ...
MW:     282.337020 g/mol MF: C17H18N2O2
IUPAC name: 3-(1-benzofuran-2-ylmethylamino)-5-ethyl-6-methyl-1H-pyridin...
Create Date: 2005-08-01
CID: 453439

5630. CHEMBL431274; 135525-68-7; 3-[(2-Benzothiazolylmethyl)amino]-5-ethyl-6-methylpyridin-2(1H)-one ...
MW:     299.390680 g/mol MF: C16H17N3OS
IUPAC name: 3-(1,3-benzothiazol-2-ylmethylamino)-5-ethyl-6-methyl-1H-pyr...
Create Date: 2005-08-01
CID: 453437

5631. SAA-10-VV-OMe; CHEMBL423661; 126333-33-3 ...
MW:     684.718022 g/mol MF: C30H49N6O10P
IUPAC name: [(1R)-1-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-hydroxypropanoyl]...
Create Date: 2005-08-01
CID: 451640

5632. 5-[(2-AMINOETHYL)AMINO]-6-FLUORO-3-(1H-PYRROL-2-YL)BENZO[CD]INDOL-2(1H)-ONE; 5BN; 1p2a ...
MW:     310.325603 g/mol MF: C17H15FN4O
IUPAC name: 5-(2-aminoethylamino)-6-fluoro-3-(1H-pyrrol-2-yl)-1H-benzo[c...
Create Date: 2005-06-24
CID: 447766

5633. NSC270738; MLS000756608; CHEMBL1594358 ...
MW:     360.428940 g/mol MF: C21H16N2O2S
IUPAC name: 2-(4-nitrophenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine
Create Date: 2005-03-26
CID: 321195

5634. 6-amino-7-methoxyquinoline-5,8-dione; 59962-98-0; NSC76889 ...
MW:     204.182120 g/mol MF: C10H8N2O3
IUPAC name: 6-amino-7-methoxyquinoline-5,8-dione
Create Date: 2005-03-26
CID: 253692

5635. FLUTIAZIN; 7220-56-6; UNII-8VNN85Y884 ...
MW:     311.279030 g/mol MF: C14H8F3NO2S
IUPAC name: 8-(trifluoromethyl)-10H-phenothiazine-1-carboxylic acid
Create Date: 2005-03-27
CID: 23647

5636. BDBM85293; Phosphinothricin analog, 6 (D,L Isomer)
MW:     207.121062 g/mol MF: C6H10NO5P
IUPAC name: (3S)-3-azaniumyl-5-[hydroxy(methyl)phosphoryl]-2H-furan-3-ca...
Create Date: 2015-10-07
CID: 91898953

5637. BDBM85292; Phosphinothricin analog, 5 (D,L Isomer)
MW:     220.182762 g/mol MF: C8H15NO4P+
IUPAC name: [(1R)-1-carboxy-3-[hydroxy(methyl)phosphoryl]cyclohex-2-en-1...
Create Date: 2015-10-07
CID: 91898951

5638. BDBM85291; Phosphinothricin analog, 4 (D,L Isomer)
MW:     205.148242 g/mol MF: C7H12NO4P
IUPAC name: (1R)-1-azaniumyl-3-[hydroxy(methyl)phosphoryl]cyclopent-2-en...
Create Date: 2015-10-07
CID: 91898949

5639. Moexipril Cyclohexyl Analogue Hydrochloride; (S)-2-{(S)-2-[(S)-4-Cyclohexyl-1-ethoxy-1-oxobutan-2-ylamino]propanoyl}-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic Acid Hydrochloride
MW:     541.076640 g/mol MF: C27H41ClN2O7
IUPAC name: (3R)-2-[(2S)-2-[[(2S)-4-cyclohexyl-1-ethoxy-1-oxobutan-2-yl]...
Create Date: 2013-11-01
CID: 71750758

5640. Vildagliptinboronic acid; 852331-49-8; Vildagliptin-Boronic Acid ...
MW:     322.207580 g/mol MF: C16H27BN2O4
IUPAC name: [(2R)-1-[2-[(3-hydroxy-1-adamantyl)amino]acetyl]pyrrolidin-2...
Create Date: 2011-11-16
CID: 53486200

5641. CHEMBL297605; BDBM50284914; MET-TAMO and N-CPM-MET-TAMO analogue
MW:     774.945240 g/mol MF: C40H46N4O8S2
IUPAC name: N-[(4aS,7aR,12bR)-9-hydroxy-3,7a-dimethyl-7-oxo-1,2,4,5,6,13...
Create Date: 2009-11-19
CID: 44292200

5642. GMPPT; gamma-methylphosphinothricin; BDBM85289 ...
MW:     194.145482 g/mol MF: C6H13NO4P-
IUPAC name: 2-azaniumyl-4-[methyl(oxido)phosphoryl]pentanoate
Create Date: 2009-03-31
CID: 25202180

5643. CHEMBL522214; SCHEMBL10240197; BDBM27086 ...
MW:     425.484180 g/mol MF: C21H27N7O3
IUPAC name: 1-[(3E)-3-[5-(morpholin-4-ylmethyl)benzimidazol-2-ylidene]-1...
Create Date: 2009-03-16
CID: 25190715

5644. CHEMBL523923; BDBM27085; pyrazole-benzimidazole urea analogue, 14 ...
MW:     418.451780 g/mol MF: C21H22N8O2
IUPAC name: 1-[(3E)-3-[5-(morpholin-4-ylmethyl)benzimidazol-2-ylidene]-1...
Create Date: 2009-03-16
CID: 25190714

5645. CHEMBL496754; SCHEMBL10240249; BDBM27084 ...
MW:     423.511360 g/mol MF: C22H29N7O2
IUPAC name: 1-cyclohexyl-3-[(3E)-3-[5-(morpholin-4-ylmethyl)benzimidazol...
Create Date: 2009-03-16
CID: 25190713

5646. CHEMBL516003; SCHEMBL10240248; BDBM27082 ...
MW:     435.454183 g/mol MF: C22H22FN7O2
IUPAC name: 1-(2-fluorophenyl)-3-[(3E)-3-[5-(morpholin-4-ylmethyl)benzim...
Create Date: 2009-03-16
CID: 25190712

5647. SCHEMBL8302938; BDBM27080; pyrazole-benzimidazole amide analogue, 9 ...
MW:     420.439543 g/mol MF: C22H21FN6O2
IUPAC name: 4-fluoro-N-[(3E)-3-[5-(morpholin-4-ylmethyl)benzimidazol-2-y...
Create Date: 2009-03-16
CID: 25190711

5648. CHEMBL496569; SCHEMBL16478930; BDBM27079 ...
MW:     402.449080 g/mol MF: C22H22N6O2
IUPAC name: N-[(3E)-3-[5-(morpholin-4-ylmethyl)benzimidazol-2-ylidene]-1...
Create Date: 2009-03-16
CID: 25190710

5649. 825615-93-8; Acetamide, N-[3-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-; CHEMBL504155 ...
MW:     241.248640 g/mol MF: C12H11N5O
IUPAC name: N-[3-(benzimidazol-2-ylidene)-1,2-dihydropyrazol-4-yl]acetam...
Create Date: 2009-03-16
CID: 25190709

5650. N-[3-(1h-Benzimidazol-2-Yl)-1h-Pyrazol-4-Yl]benzamide; Benzamide, N-[3-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-; N-[3-(1H-1,3-benzodiazol-2-yl)-1H-pyrazol-4-yl]benzamide ...
MW:     303.318020 g/mol MF: C17H13N5O
IUPAC name: N-[3-(benzimidazol-2-ylidene)-1,2-dihydropyrazol-4-yl]benzam...
Create Date: 2009-01-30
CID: 25138278

5651. CHEMBL458420; SCHEMBL8299915; BDBM27081 ...
MW:     417.463720 g/mol MF: C22H23N7O2
IUPAC name: 1-[(3E)-3-[5-(morpholin-4-ylmethyl)benzimidazol-2-ylidene]-1...
Create Date: 2009-01-30
CID: 25138277

5652. CHEMBL492258; BDBM24944; 5-oxo dihydronaphthylcarbazole analogue, 9 ...
MW:     382.454380 g/mol MF: C25H22N2O2
Create Date: 2008-10-21
CID: 24971430

5653. CHEMBL492257; SCHEMBL2755778; BDBM24943 ...
MW:     354.401220 g/mol MF: C23H18N2O2
Create Date: 2008-10-21
CID: 24971429

5654. CHEMBL515822; SCHEMBL4074207; BDBM24704 ...
MW:     415.287060 g/mol MF: C18H19BrN6O
IUPAC name: (2R)-2-[[5-bromo-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyr...
Create Date: 2008-10-13
CID: 24949401

5655. CHEMBL456549; SCHEMBL4459019; BDBM24702 ...
MW:     399.287660 g/mol MF: C18H19BrN6
IUPAC name: 5-bromo-4-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-N-[(1R)-1-phen...
Create Date: 2008-10-13
CID: 24949400

5656. CHEMBL464801; SCHEMBL4069157; BDBM24701 ...
MW:     399.287660 g/mol MF: C18H19BrN6
IUPAC name: 5-bromo-4-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-N-[(1S)-1-phen...
Create Date: 2008-10-13
CID: 24949399

5657. CHEMBL517943; BDBM24699; 4-aminopyrazolylpyrimidine analogue, 10e ...
MW:     403.251543 g/mol MF: C17H16BrFN6
IUPAC name: 5-bromo-4-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-N-[(4-fluoroph...
Create Date: 2008-10-13
CID: 24949398

5658. CHEMBL464179; SCHEMBL11348597; BDBM24697 ...
MW:     419.706140 g/mol MF: C17H16BrClN6
IUPAC name: 5-bromo-2-N-[(2-chlorophenyl)methyl]-4-N-(5-cyclopropyl-1H-p...
Create Date: 2008-10-13
CID: 24949248

5659. CHEMBL496483; SCHEMBL11348625; BDBM24695 ...
MW:     385.261080 g/mol MF: C17H17BrN6
IUPAC name: 2-N-benzyl-5-bromo-4-N-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimi...
Create Date: 2008-10-13
CID: 24949247

5660. CHEMBL516142; SCHEMBL4072155; BDBM24707 ...
MW:     443.905023 g/mol MF: C21H23ClFN7O
IUPAC name: (3S)-3-[[5-chloro-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]py...
Create Date: 2008-10-13
CID: 24949093

5661. CHEMBL507748; SCHEMBL4160289; BDBM24703 ...
MW:     415.287060 g/mol MF: C18H19BrN6O
IUPAC name: (2S)-2-[[5-bromo-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyr...
Create Date: 2008-10-13
CID: 24949092

5662. CHEMBL464800; SCHEMBL11343199; BDBM24700 ...
MW:     419.706140 g/mol MF: C17H16BrClN6
IUPAC name: 5-bromo-2-N-[(4-chlorophenyl)methyl]-4-N-(5-cyclopropyl-1H-p...
Create Date: 2008-10-13
CID: 24949091

5663. CHEMBL521895; SCHEMBL11341643; BDBM24696 ...
MW:     415.287060 g/mol MF: C18H19BrN6O
IUPAC name: 5-bromo-4-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-N-[(3-methoxyp...
Create Date: 2008-10-13
CID: 24948938

5664. CHEMBL272618; BDBM23779; ZINC8638136 ...
MW:     413.531320 g/mol MF: C26H23NO2S
IUPAC name: (2R)-2-amino-3-[naphthalen-1-yl(diphenyl)methyl]sulfanylprop...
Create Date: 2008-07-30
CID: 24860488

5665. CHEMBL405611; BDBM23774; S-Trityl-L-Cysteine (STLC) Analogue, 3 ...
MW:     301.403260 g/mol MF: C17H19NO2S
IUPAC name: (2R)-2-amino-3-(1,1-diphenylethylsulfanyl)propanoic acid
Create Date: 2008-07-30
CID: 24860487

5666. CHEMBL383533; BDBM22436; 4-hydroxytamoxifen (4-OHT) analog, 16 ...
MW:     431.566520 g/mol MF: C28H33NO3
IUPAC name: 4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]-6-hydroxy-2-phe...
Create Date: 2008-07-07
CID: 24825454

5667. CHEMBL204376; BDBM22434; 4-hydroxytamoxifen (4-OHT) analog, 14 ...
MW:     403.513360 g/mol MF: C26H29NO3
IUPAC name: 4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]-4-hydroxy-2-phe...
Create Date: 2008-07-07
CID: 24825453

5668. CHEMBL202302; BDBM22433; 4-hydroxytamoxifen (4-OHT) analog, 13 ...
MW:     458.591860 g/mol MF: C29H34N2O3
IUPAC name: N-[(Z)-5-[4-[2-(dimethylamino)ethoxy]phenyl]-5-(4-hydroxyphe...
Create Date: 2008-07-07
CID: 24825452

5669. CHEMBL201309; BDBM22432; 4-hydroxytamoxifen (4-OHT) analog, 12 ...
MW:     444.608340 g/mol MF: C29H36N2O2
IUPAC name: 4-[(Z)-5-(dimethylamino)-1-[4-[2-(dimethylamino)ethoxy]pheny...
Create Date: 2008-07-07
CID: 24825451

5670. CHEMBL437700; BDBM22431; 4-hydroxytamoxifen (4-OHT) analog, 11 ...
MW:     430.581760 g/mol MF: C28H34N2O2
IUPAC name: 4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]-5-(methylamino)...
Create Date: 2008-07-07
CID: 24825450

5671. CHEMBL371972; BDBM22430; 4-hydroxytamoxifen (4-OHT) analog, 10 ...
MW:     445.550040 g/mol MF: C28H31NO4
IUPAC name: (Z)-6-[4-[2-(dimethylamino)ethoxy]phenyl]-6-(4-hydroxyphenyl...
Create Date: 2008-07-07
CID: 24825449

5672. CHEMBL270138; BDBM23778; S-Trityl-L-Cysteine (STLC) Analogue, 7 ...
MW:     369.520280 g/mol MF: C22H27NO2S
IUPAC name: (2R)-2-amino-3-[cyclohexyl(diphenyl)methyl]sulfanylpropanoic...
Create Date: 2008-06-09
CID: 24806227

5673. CHEMBL259257; BDBM23777; S-Trityl-L-Cysteine (STLC) Analogue, 6 ...
MW:     329.456420 g/mol MF: C19H23NO2S
IUPAC name: (2R)-2-amino-3-(2-methyl-1,1-diphenylpropyl)sulfanylpropanoi...
Create Date: 2008-06-09
CID: 24806226

5674. CHEMBL259256; BDBM23776; S-Trityl-L-Cysteine (STLC) Analogue, 5 ...
MW:     343.483000 g/mol MF: C20H25NO2S
IUPAC name: (2R)-2-amino-3-(1,1-diphenylpentylsulfanyl)propanoic acid
Create Date: 2008-06-09
CID: 24806225

5675. CHEMBL405609; BDBM23775; S-Trityl-L-Cysteine (STLC) Analogue, 4 ...
MW:     315.429840 g/mol MF: C18H21NO2S
IUPAC name: (2R)-2-amino-3-(1,1-diphenylpropylsulfanyl)propanoic acid
Create Date: 2008-06-09
CID: 24806224

5676. CHEMBL429308; BDBM20687; Pyrrolo[3,2-d]pyrimidine analogue, 15 ...
MW:     323.177280 g/mol MF: C14H12Cl2N4O
IUPAC name: 2-amino-5-[(3,4-dichlorophenyl)methyl]-6-methyl-1H-pyrrolo[3...
Create Date: 2008-03-24
CID: 24754979

5677. CHEMBL401074; BDBM20685; Pyrrolo[3,2-d]pyrimidine analogue, 13 ...
MW:     323.177280 g/mol MF: C14H12Cl2N4O
IUPAC name: 2-amino-5-[(3,5-dichlorophenyl)methyl]-6-methyl-1H-pyrrolo[3...
Create Date: 2008-03-24
CID: 24754978

5678. CHEMBL253581; BDBM20683; Pyrrolo[3,2-d]pyrimidine analogue, 11 ...
MW:     284.313140 g/mol MF: C15H16N4O2
IUPAC name: 2-amino-5-[(4-methoxyphenyl)methyl]-6-methyl-1H-pyrrolo[3,2-...
Create Date: 2008-03-24
CID: 24754977

5679. CHEMBL401073; BDBM20682; Pyrrolo[3,2-d]pyrimidine analogue, 10 ...
MW:     299.284720 g/mol MF: C14H13N5O3
IUPAC name: 2-amino-6-methyl-5-[(4-nitrophenyl)methyl]-1H-pyrrolo[3,2-d]...
Create Date: 2008-03-24
CID: 24754976

5680. CHEMBL253796; BDBM20686; Pyrrolo[3,2-d]pyrimidine analogue, 14 ...
MW:     412.079280 g/mol MF: C14H12Br2N4O
IUPAC name: 2-amino-5-[(3,5-dibromophenyl)methyl]-6-methyl-1H-pyrrolo[3,...
Create Date: 2008-03-24
CID: 24754678

5681. CHEMBL253795; BDBM20684; Pyrrolo[3,2-d]pyrimidine analogue, 12 ...
MW:     338.284530 g/mol MF: C15H13F3N4O2
IUPAC name: 2-amino-6-methyl-5-[[4-(trifluoromethoxy)phenyl]methyl]-1H-p...
Create Date: 2008-03-24
CID: 24754677

5682. CHEMBL398983; BDBM23009; N-arachidonoylserotonin urea analogue, 2g ...
MW:     415.484300 g/mol MF: C25H25N3O3
IUPAC name: 1-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-3-[2-(4-phenoxyphenyl)e...
Create Date: 2008-03-17
CID: 24749486

5683. CHEMBL240687; BDBM23008; N-arachidonoylserotonin urea analogue, 2f ...
MW:     399.484900 g/mol MF: C25H25N3O2
IUPAC name: 1-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-3-[2-(4-phenylphenyl)et...
Create Date: 2008-03-17
CID: 24749485

5684. CHEMBL398780; BDBM23007; N-arachidonoylserotonin urea analogue, 2e ...
MW:     371.431740 g/mol MF: C23H21N3O2
IUPAC name: 1-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-3-(3-phenylphenyl)urea
Create Date: 2008-03-17
CID: 24749379

5685. CHEMBL240474; BDBM23006; N-arachidonoylserotonin urea analogue, 2d ...
MW:     357.834000 g/mol MF: C19H20ClN3O2
IUPAC name: 1-[2-(4-chlorophenyl)ethyl]-3-[2-(5-hydroxy-1H-indol-3-yl)et...
Create Date: 2008-03-17
CID: 24749378

5686. CHEMBL240473; BDBM23005; N-arachidonoylserotonin urea analogue, 2c ...
MW:     323.388940 g/mol MF: C19H21N3O2
IUPAC name: 1-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-3-(2-phenylethyl)urea
Create Date: 2008-03-17
CID: 24749377

5687. CHEMBL391562; BDBM23004; N-arachidonoylserotonin urea analogue, 2b ...
MW:     365.468680 g/mol MF: C22H27N3O2
IUPAC name: 1-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-3-(3-pentylphenyl)urea
Create Date: 2008-03-17
CID: 24749376

5688. CHEMBL235984; BDBM23003; N-arachidonoylserotonin urea analogue, 2a
MW:     365.468680 g/mol MF: C22H27N3O2
IUPAC name: 1-[(4-tert-butylphenyl)methyl]-3-[2-(5-hydroxy-1H-indol-3-yl...
Create Date: 2008-03-17
CID: 24749375

5689. CHEMBL442702; BDBM18265; Pyrrolo[2, 3-d]pyrimidine analogue, 1h ...
MW:     340.230940 g/mol MF: C13H11Cl2N5S
IUPAC name: 6-(3,4-dichlorophenyl)sulfanyl-5-methyl-7H-pyrrolo[2,3-d]pyr...
Create Date: 2008-01-19
CID: 23647977

5690. CHEMBL227065; BDBM18262; Pyrrolo[2, 3-d]pyrimidine analogue, 1b ...
MW:     321.399500 g/mol MF: C17H15N5S
IUPAC name: 5-methyl-6-naphthalen-2-ylsulfanyl-7H-pyrrolo[2,3-d]pyrimidi...
Create Date: 2008-01-19
CID: 23647976

5691. CHEMBL200858; SCHEMBL1124079; BDBM16118 ...
MW:     387.836760 g/mol MF: C19H14ClNO4S
IUPAC name: 3-[[3-chloro-4-(2-methoxyphenyl)phenyl]carbamoyl]thiophene-2...
Create Date: 2008-01-19
CID: 23647301

5692. CHEMBL200856; SCHEMBL1124423; BDBM16116 ...
MW:     403.399206 g/mol MF: C20H15F2NO4S
IUPAC name: 3-[[4-(2-ethoxyphenyl)-2,6-difluorophenyl]carbamoyl]thiophen...
Create Date: 2008-01-19
CID: 23647300

5693. CHEMBL200699; SCHEMBL1124114; BDBM16115 ...
MW:     403.399206 g/mol MF: C20H15F2NO4S
IUPAC name: 3-[[4-(3-ethoxyphenyl)-2,6-difluorophenyl]carbamoyl]thiophen...
Create Date: 2008-01-19
CID: 23647299

5694. CHEMBL496879; (20s)-19,20,21,22-tetrahydro-19-oxo-5h-18,20-ethano-12,14-etheno-6,10-metheno-18h-benz[d]imidazo[4,3-k][1,6,9,12]oxatriaza-cyclooctadecosine-9-carbonitrile; BDBM14010 ...
MW:     435.477240 g/mol MF: C26H21N5O2
Create Date: 2008-01-19
CID: 23646577

5695. CHEMBL524862; BDBM14008; Macrocyclic 3-Aminopyrrolidinone analog 42 ...
MW:     461.514520 g/mol MF: C28H23N5O2
Create Date: 2008-01-19
CID: 23646576

5696. CHEMBL72056; BDBM9980; 6-Substituted Androst-4-ene Analog 15e ...
MW:     386.653540 g/mol MF: C27H46O
IUPAC name: (6R)-10,13-dimethyl-6-octyl-2,3,6,7,8,9,11,12,14,15,16,17-do...
Create Date: 2008-01-19
CID: 23645007

5697. CHEMBL73219; BDBM9979; 6-Substituted Androst-4-ene Analog 15d ...
MW:     344.573800 g/mol MF: C24H40O
IUPAC name: (6R)-10,13-dimethyl-6-pentyl-2,3,6,7,8,9,11,12,14,15,16,17-d...
Create Date: 2008-01-19
CID: 23645006

5698. CHEMBL73071; BDBM9978; 6-Substituted Androst-4-ene Analog 15c ...
MW:     316.520640 g/mol MF: C22H36O
IUPAC name: (6R)-10,13-dimethyl-6-propyl-2,3,6,7,8,9,11,12,14,15,16,17-d...
Create Date: 2008-01-19
CID: 23645005

5699. BDBM9977; CHEMBL306022; 6-Substituted Androst-4-ene Analog 15b ...
MW:     302.494060 g/mol MF: C21H34O
IUPAC name: (6R)-6-ethyl-10,13-dimethyl-2,3,6,7,8,9,11,12,14,15,16,17-do...
Create Date: 2008-01-19
CID: 23645004

5700. CHEMBL73367; BDBM9976; 6-Substituted Androst-4-ene Analog 15a ...
MW:     288.467480 g/mol MF: C20H32O
IUPAC name: (6R)-6,10,13-trimethyl-2,3,6,7,8,9,11,12,14,15,16,17-dodecah...
Create Date: 2008-01-19
CID: 23645003

5701. CHEMBL73368; BDBM9975; 6-Substituted Androst-4-ene Analog 14e ...
MW:     386.653540 g/mol MF: C27H46O
IUPAC name: (6S)-10,13-dimethyl-6-octyl-2,3,6,7,8,9,11,12,14,15,16,17-do...
Create Date: 2008-01-19
CID: 23645002

5702. BDBM9974; CHEMBL307006; 6-Substituted Androst-4-ene Analog 14d ...
MW:     344.573800 g/mol MF: C24H40O
IUPAC name: (6S)-10,13-dimethyl-6-pentyl-2,3,6,7,8,9,11,12,14,15,16,17-d...
Create Date: 2008-01-19
CID: 23645001

5703. CHEMBL69891; BDBM9973; 6-Substituted Androst-4-ene Analog 14c ...
MW:     316.520640 g/mol MF: C22H36O
IUPAC name: (6S)-10,13-dimethyl-6-propyl-2,3,6,7,8,9,11,12,14,15,16,17-d...
Create Date: 2008-01-19
CID: 23645000

5704. CHEMBL74339; BDBM9972; 6-Substituted Androst-4-ene Analog 14b ...
MW:     302.494060 g/mol MF: C21H34O
IUPAC name: (6S)-6-ethyl-10,13-dimethyl-2,3,6,7,8,9,11,12,14,15,16,17-do...
Create Date: 2008-01-19
CID: 23644999

5705. CHEMBL70959; BDBM9971; 6-Substituted Androst-4-ene Analog 14a ...
MW:     288.467480 g/mol MF: C20H32O
IUPAC name: (6S)-6,10,13-trimethyl-2,3,6,7,8,9,11,12,14,15,16,17-dodecah...
Create Date: 2008-01-19
CID: 23644998

5706. CHEMBL72538; BDBM9964; 6-Substituted Androst-4-ene Analog 19e ...
MW:     384.637660 g/mol MF: C27H44O
IUPAC name: (6R)-10,13-dimethyl-6-octyl-1,2,3,6,7,8,9,11,12,14,15,16-dod...
Create Date: 2008-01-19
CID: 23644991

5707. CHEMBL72415; BDBM9963; 6-Substituted Androst-4-ene Analog 19d ...
MW:     342.557920 g/mol MF: C24H38O
IUPAC name: (6R)-10,13-dimethyl-6-pentyl-1,2,3,6,7,8,9,11,12,14,15,16-do...
Create Date: 2008-01-19
CID: 23644990

5708. CHEMBL70317; BDBM9962; 6-Substituted Androst-4-ene Analog 19c ...
MW:     314.504760 g/mol MF: C22H34O
IUPAC name: (6R)-10,13-dimethyl-6-propyl-1,2,3,6,7,8,9,11,12,14,15,16-do...
Create Date: 2008-01-19
CID: 23644989

5709. BDBM9961; CHEMBL307690; 6-Substituted Androst-4-ene Analog 19b ...
MW:     300.478180 g/mol MF: C21H32O
IUPAC name: (6R)-6-ethyl-10,13-dimethyl-1,2,3,6,7,8,9,11,12,14,15,16-dod...
Create Date: 2008-01-19
CID: 23644988

5710. BDBM9960; CHEMBL305205; 6-Substituted Androst-4-ene Analog 19a ...
MW:     286.451600 g/mol MF: C20H30O
IUPAC name: (6R)-6,10,13-trimethyl-1,2,3,6,7,8,9,11,12,14,15,16-dodecahy...
Create Date: 2008-01-19
CID: 23644987

5711. CHEMBL74295; BDBM9959; 6-Substituted Androst-4-ene Analog 18e ...
MW:     384.637660 g/mol MF: C27H44O
IUPAC name: (6S)-10,13-dimethyl-6-octyl-1,2,3,6,7,8,9,11,12,14,15,16-dod...
Create Date: 2008-01-19
CID: 23644986

5712. BDBM9958; CHEMBL305630; 6-Substituted Androst-4-ene Analog 18d ...
MW:     342.557920 g/mol MF: C24H38O
IUPAC name: (6S)-10,13-dimethyl-6-pentyl-1,2,3,6,7,8,9,11,12,14,15,16-do...
Create Date: 2008-01-19
CID: 23644985

5713. BDBM9957; CHEMBL304305; 6-Substituted Androst-4-ene Analog 18c ...
MW:     314.504760 g/mol MF: C22H34O
IUPAC name: (6S)-10,13-dimethyl-6-propyl-1,2,3,6,7,8,9,11,12,14,15,16-do...
Create Date: 2008-01-19
CID: 23644984

5714. CHEMBL70436; BDBM9956; 6-Substituted Androst-4-ene Analog 18b ...
MW:     300.478180 g/mol MF: C21H32O
IUPAC name: (6S)-6-ethyl-10,13-dimethyl-1,2,3,6,7,8,9,11,12,14,15,16-dod...
Create Date: 2008-01-19
CID: 23644983

5715. BDBM9955; CHEMBL310735; 6-Substituted Androst-4-ene Analog 18a ...
MW:     286.451600 g/mol MF: C20H30O
IUPAC name: (6S)-6,10,13-trimethyl-1,2,3,6,7,8,9,11,12,14,15,16-dodecahy...
Create Date: 2008-01-19
CID: 23644982

5716. CHEMBL524997; BDBM14007; Macrocyclic 3-Aminopyrrolidinone analog 37 ...
MW:     478.341200 g/mol MF: C23H20BrN5O2
Create Date: 2008-01-19
CID: 23644676

5717. NSC-123529; CHEMBL261613; BDBM23780 ...
MW:     413.531320 g/mol MF: C26H23NO2S
IUPAC name: (2R)-2-amino-3-[naphthalen-2-yl(diphenyl)methyl]sulfanylprop...
Create Date: 2007-12-05
CID: 21144445

5718. CHEMBL1186506; BDBM26975; 2-benzoylquinazoline analogue, (rac)-17 ...
MW:     451.951840 g/mol MF: C23H26ClN7O
IUPAC name: 4-chloro-N-[4-[[2-(diaminomethylideneamino)cyclohexyl]amino]...
Create Date: 2007-12-04
CID: 17864714

5719. CHEMBL227064; BDBM18259; Pyrrolo[2, 3-d]pyrimidine analogue, 17 ...
MW:     313.420560 g/mol MF: C16H19N5S
IUPAC name: 6-(2,6-dimethylphenyl)sulfanyl-5-ethyl-7H-pyrrolo[2,3-d]pyri...
Create Date: 2007-09-17
CID: 16733165

5720. CHEMBL389686; BDBM18257; Pyrrolo[2, 3-d]pyrimidine analogue, 15 ...
MW:     285.367400 g/mol MF: C14H15N5S
IUPAC name: 5-ethyl-6-phenylsulfanyl-7H-pyrrolo[2,3-d]pyrimidine-2,4-dia...
Create Date: 2007-09-17
CID: 16733164

5721. CHEMBL388121; BDBM18254; Pyrrolo[2, 3-d]pyrimidine analogue, 12 ...
MW:     315.393380 g/mol MF: C15H17N5OS
IUPAC name: 5-ethyl-6-(4-methoxyphenyl)sulfanyl-7H-pyrrolo[2,3-d]pyrimid...
Create Date: 2007-09-17
CID: 16733163

5722. CHEMBL388120; BDBM18253; Pyrrolo[2, 3-d]pyrimidine analogue, 10 ...
MW:     354.257520 g/mol MF: C14H13Cl2N5S
IUPAC name: 6-(2,4-dichlorophenyl)sulfanyl-5-ethyl-7H-pyrrolo[2,3-d]pyri...
Create Date: 2007-09-17
CID: 16733162

5723. CHEMBL227063; BDBM18258; Pyrrolo[2, 3-d]pyrimidine analogue, 16 ...
MW:     336.414140 g/mol MF: C17H16N6S
IUPAC name: 5-ethyl-6-quinolin-8-ylsulfanyl-7H-pyrrolo[2,3-d]pyrimidine-...
Create Date: 2007-09-17
CID: 16733036

5724. CHEMBL227010; BDBM18256; Pyrrolo[2, 3-d]pyrimidine analogue, 14 ...
MW:     315.393380 g/mol MF: C15H17N5OS
IUPAC name: 5-ethyl-6-(3-methoxyphenyl)sulfanyl-7H-pyrrolo[2,3-d]pyrimid...
Create Date: 2007-09-17
CID: 16733035

5725. CHEMBL227009; BDBM18255; Pyrrolo[2, 3-d]pyrimidine analogue, 13 ...
MW:     345.419360 g/mol MF: C16H19N5O2S
IUPAC name: 6-(2,5-dimethoxyphenyl)sulfanyl-5-ethyl-7H-pyrrolo[2,3-d]pyr...
Create Date: 2007-09-17
CID: 16733034

5726. CHEMBL227008; BDBM18261; Pyrrolo[2, 3-d]pyrimidine analogue, 11 ...
MW:     354.257520 g/mol MF: C14H13Cl2N5S
IUPAC name: 6-(2,6-dichlorophenyl)sulfanyl-5-ethyl-7H-pyrrolo[2,3-d]pyri...
Create Date: 2007-09-17
CID: 16733033

5727. CHEMBL226955; BDBM18260; Pyrrolo[2, 3-d]pyrimidine analogue, 8 ...
MW:     319.812460 g/mol MF: C14H14ClN5S
IUPAC name: 6-(4-chlorophenyl)sulfanyl-5-ethyl-7H-pyrrolo[2,3-d]pyrimidi...
Create Date: 2007-09-17
CID: 16733031

5728. CHEMBL387901; BDBM18251; Pyrrolo[2, 3-d]pyrimidine analogue, 7 ...
MW:     319.812460 g/mol MF: C14H14ClN5S
IUPAC name: 6-(3-chlorophenyl)sulfanyl-5-ethyl-7H-pyrrolo[2,3-d]pyrimidi...
Create Date: 2007-09-17
CID: 16733030

5729. CHEMBL226954; BDBM18250; Pyrrolo[2, 3-d]pyrimidine analogue, 6 ...
MW:     364.263460 g/mol MF: C14H14BrN5S
IUPAC name: 6-(4-bromophenyl)sulfanyl-5-ethyl-7H-pyrrolo[2,3-d]pyrimidin...
Create Date: 2007-09-17
CID: 16733029

5730. CHEMBL389887; BDBM18249; Pyrrolo[2, 3-d]pyrimidine analogue, 5 ...
MW:     330.364960 g/mol MF: C14H14N6O2S
IUPAC name: 5-ethyl-6-(4-nitrophenyl)sulfanyl-7H-pyrrolo[2,3-d]pyrimidin...
Create Date: 2007-09-17
CID: 16732893

5731. CHEMBL226953; BDBM18248; Pyrrolo[2, 3-d]pyrimidine analogue, 4 ...
MW:     335.426080 g/mol MF: C18H17N5S
IUPAC name: 5-ethyl-6-naphthalen-2-ylsulfanyl-7H-pyrrolo[2,3-d]pyrimidin...
Create Date: 2007-09-17
CID: 16732892

5732. CHEMBL226952; BDBM18247; Pyrrolo[2, 3-d]pyrimidine analogue, 3 ...
MW:     335.426080 g/mol MF: C18H17N5S
IUPAC name: 5-ethyl-6-naphthalen-1-ylsulfanyl-7H-pyrrolo[2,3-d]pyrimidin...
Create Date: 2007-09-17
CID: 16732891

5733. 3-{[(3-Fluoro-3'-Methoxybiphenyl-4-Yl)amino]carbonyl}thiophene-2-Carboxylic Acid; 3-[[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl]thiophene-2-carboxylic acid; 3-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}thiophene-2-carboxylic acid ...
MW:     371.382163 g/mol MF: C19H14FNO4S
IUPAC name: 3-[[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl]thiophene-2...
Create Date: 2007-02-23
CID: 15942657

5734. CHEMBL514257; SCHEMBL3341202; BDBM24706 ...
MW:     388.826523 g/mol MF: C18H18ClFN6O
IUPAC name: (2R)-2-[[5-chloro-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]py...
Create Date: 2007-01-03
CID: 11978451

5735. BDBM19162; chlamydocin-hydroxymethylketone analog, 10; (3S,9S,14aR)-9-benzyl-3-(7-hydroxy-6-oxoheptyl)-6,6-dimethyl-tetradecahydropyrrolo[1,2-a][,,,]cyclododecane-1,4,7,10-tetrone
MW:     514.613820 g/mol MF: C27H38N4O6
IUPAC name: (3S,9S,12R)-3-benzyl-9-(7-hydroxy-6-oxoheptyl)-6,6-dimethyl-...
Create Date: 2006-12-18
CID: 11964530

5736. (1R,5R)-30-OXO-19-OXA-2,6,10,12-TETRAAZAHEXACYCLO[18.6.2.1^{2,5}.1^{14,18}.0^{8,12}.0^{23,27}]TRIACONTA-8,10,14(29),15,17,20(28),21,23(27)-OCTAENE-17-CARBONITRILE (STRUCTURAL MIX); CHEMBL525369; BDBM14023 ...
MW:     439.509000 g/mol MF: C26H25N5O2
Create Date: 2006-10-26
CID: 11761968

5737. CHEMBL496065; BDBM14022; Macrocyclic 3-Aminopyrrolidinone analog 82 ...
MW:     439.509000 g/mol MF: C26H25N5O2
Create Date: 2006-10-26
CID: 11732896

5738. CHEMBL524909; BDBM13999; Macrocyclic 3-Aminopyrrolidinone analog 12 ...
MW:     399.445140 g/mol MF: C23H21N5O2
Create Date: 2006-10-26
CID: 11732098

5739. CHEMBL202176; BDBM18804; Pyrrolo[2,3-d]pyrimidine analogue, 12 ...
MW:     365.248220 g/mol MF: C14H13BrN4OS
IUPAC name: 2-amino-5-(3-bromophenyl)sulfanyl-6-ethyl-1,7-dihydropyrrolo...
Create Date: 2006-10-26
CID: 11717558

5740. CHEMBL202337; BDBM18813; Pyrrolo[2,3-d]pyrimidine analogue, 17 ...
MW:     336.410840 g/mol MF: C18H16N4OS
IUPAC name: 2-amino-6-ethyl-5-naphthalen-2-ylsulfanyl-1,7-dihydropyrrolo...
Create Date: 2006-10-26
CID: 11702789

5741. CHEMBL436761; BDBM18812; Pyrrolo[2,3-d]pyrimidine analogue, 16 ...
MW:     336.410840 g/mol MF: C18H16N4OS
IUPAC name: 2-amino-6-ethyl-5-naphthalen-1-ylsulfanyl-1,7-dihydropyrrolo...
Create Date: 2006-10-26
CID: 11667192

5742. CHEMBL383829; BDBM18810; Pyrrolo[2,3-d]pyrimidine analogue, 10 ...
MW:     316.378140 g/mol MF: C15H16N4O2S
IUPAC name: 2-amino-6-ethyl-5-(4-methoxyphenyl)sulfanyl-1,7-dihydropyrro...
Create Date: 2006-10-26
CID: 11594848

5743. CHEMBL202490; BDBM18805; Pyrrolo[2,3-d]pyrimidine analogue, 14 ...
MW:     422.348099 g/mol MF: C16H12F6N4OS
IUPAC name: 2-amino-5-[3,5-bis(trifluoromethyl)phenyl]sulfanyl-6-ethyl-1...
Create Date: 2006-10-26
CID: 11589874

5744. CHEMBL369906; BDBM18811; Pyrrolo[2,3-d]pyrimidine analogue, 13 ...
MW:     316.378140 g/mol MF: C15H16N4O2S
IUPAC name: 2-amino-6-ethyl-5-(3-methoxyphenyl)sulfanyl-1,7-dihydropyrro...
Create Date: 2006-10-26
CID: 11587749

5745. CHEMBL505965; SCHEMBL11342407; BDBM24698 ...
MW:     415.287060 g/mol MF: C18H19BrN6O
IUPAC name: 5-bromo-4-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-N-[(2-methoxyp...
Create Date: 2006-10-26
CID: 11560696

5746. CHEMBL458421; SCHEMBL10240051; BDBM27083 ...
MW:     453.444646 g/mol MF: C22H21F2N7O2
IUPAC name: 1-(2,6-difluorophenyl)-3-[(3E)-3-[5-(morpholin-4-ylmethyl)be...
Create Date: 2006-10-26
CID: 11541949

5747. CHEMBL199361; SCHEMBL1124227; BDBM16117 ...
MW:     425.353553 g/mol MF: C19H11F4NO4S
IUPAC name: 3-[[2,3,5,6-tetrafluoro-4-(2-methoxyphenyl)phenyl]carbamoyl]...
Create Date: 2006-10-26
CID: 11524688

5748. CHEMBL201618; BDBM18803; Pyrrolo[2,3-d]pyrimidine analogue, 11 ...
MW:     320.797220 g/mol MF: C14H13ClN4OS
IUPAC name: 2-amino-5-(3-chlorophenyl)sulfanyl-6-ethyl-1,7-dihydropyrrol...
Create Date: 2006-10-26
CID: 11515277

5749. CHEMBL202098; BDBM18806; Pyrrolo[2,3-d]pyrimidine analogue, 15 ...
MW:     314.405320 g/mol MF: C16H18N4OS
IUPAC name: 2-amino-5-(2,6-dimethylphenyl)sulfanyl-6-ethyl-1,7-dihydropy...
Create Date: 2006-10-26
CID: 11507922

5750. AT9283; UNII-XAV9KYN9WL; AT-9283 ...
MW:     381.431620 g/mol MF: C19H23N7O2
IUPAC name: 1-cyclopropyl-3-[(3E)-3-[5-(morpholin-4-ylmethyl)benzimidazo...
Create Date: 2006-10-26
CID: 11496629

5751. CHEMBL456985; SCHEMBL3338683; BDBM24708 ...
MW:     429.878443 g/mol MF: C20H21ClFN7O
IUPAC name: (3S)-3-[[5-chloro-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]py...
Create Date: 2006-10-26
CID: 11441796

5752. CHEMBL187765; BDBM16062; truncated OM99-2 cyclopentano analog 35 ...
MW:     600.767720 g/mol MF: C28H48N4O8S
IUPAC name: (2S)-2-[[(1R,2R)-2-[(1S,2S)-2-[[(2S)-2-[[(2S)-2-acetamido-4-...
Create Date: 2006-10-26
CID: 11410845

5753. CHEMBL191123; BDBM16063; truncated OM99-2 cyclopentano analog 34 ...
MW:     598.794900 g/mol MF: C29H50N4O7S
IUPAC name: (2S)-2-[[(1R,2R)-2-[(1S,2S)-2-[[(2S)-2-[[(2S)-2-acetamido-4-...
Create Date: 2006-10-26
CID: 11319368

5754. CHEMBL363783; BDBM16050; truncated OM99-2 cyclopentano analog 4 ...
MW:     771.855480 g/mol MF: C34H57N7O13
IUPAC name: (2S)-2-[[(2S)-2-[[(1R,2R)-2-[(1S,2S)-2-[[(2S)-4-amino-2-[[(2...
Create Date: 2006-10-26
CID: 11308746

5755. CHEMBL190058; BDBM16056; truncated OM99-2 cyclopentano analog 50 ...
MW:     570.827860 g/mol MF: C29H54N4O5S
IUPAC name: (1R,2R)-2-[(1S,2S)-2-[[(2S)-2-[[(2S)-2-acetamido-4-methylpen...
Create Date: 2006-10-26
CID: 11307634

5756. CHEMBL190010; BDBM16052; truncated OM99-2 cyclopentano analog 36 ...
MW:     586.784200 g/mol MF: C28H50N4O7S
IUPAC name: (2S)-2-[[(1R,2R)-2-[(1S,2S)-2-[[(2S)-2-[[(2S)-2-acetamido-4-...
Create Date: 2006-10-26
CID: 11284734

5757. CHEMBL191344; BDBM16055; truncated OM99-2 cyclopentano analog 47 ...
MW:     669.958920 g/mol MF: C34H63N5O6S
IUPAC name: (1R,2R)-2-[(1S,2S)-2-[[(2S)-2-[[(2S)-2-acetamido-4-methylpen...
Create Date: 2006-10-26
CID: 11227663

5758. CHEMBL456976; SCHEMBL3338860; BDBM24705 ...
MW:     417.278123 g/mol MF: C18H18BrFN6
IUPAC name: 5-bromo-4-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-N-[(1S)-1-(4-f...
Create Date: 2006-10-26
CID: 11212221

5759. CHEMBL364446; BDBM16053; truncated OM99-2 cyclopentano analog 40 ...
MW:     614.837360 g/mol MF: C30H54N4O7S
IUPAC name: (2S)-2-[[(1R,2R)-2-[(1S,2S)-2-[[(2S)-2-[[(2S)-2-acetamido-4-...
Create Date: 2006-10-26
CID: 11204313

5760. CHEMBL192836; BDBM16054; truncated OM99-2 cyclopentano analog 46 ...
MW:     641.905760 g/mol MF: C32H59N5O6S
IUPAC name: (1R,2R)-2-[(1S,2S)-2-[[(2S)-2-[[(2S)-2-acetamido-4-methylpen...
Create Date: 2006-10-26
CID: 11169672

5761. CHEMBL523080; BDBM14012; Macrocyclic 3-Aminopyrrolidinone analog 56 ...
MW:     463.487340 g/mol MF: C27H21N5O3
Create Date: 2006-10-26
CID: 11145028

5762. CHEMBL526521; BDBM14024; Macrocyclic 3-Aminopyrrolidinone analog 84 ...
MW:     439.509000 g/mol MF: C26H25N5O2
Create Date: 2006-10-26
CID: 11144668

5763. CHEMBL524352; BDBM14000; Macrocyclic 3-Aminopyrrolidinone analog 16 ...
MW:     433.890200 g/mol MF: C23H20ClN5O2
Create Date: 2006-10-26
CID: 11070099

5764. CHEMBL465417; BDBM14026; Macrocyclic 3-Aminopyrrolidinone analog 86 ...
MW:     441.481820 g/mol MF: C25H23N5O3
Create Date: 2006-10-26
CID: 11026589

5765. CHEMBL525368; BDBM14016; Macrocyclic 3-Aminopyrrolidinone analog 68 ...
MW:     463.530400 g/mol MF: C28H25N5O2
Create Date: 2006-10-26
CID: 11016041

5766. CHEMBL497048; BDBM14011; Macrocyclic 3-Aminopyrrolidinone analog 51 ...
MW:     449.503820 g/mol MF: C27H23N5O2
Create Date: 2006-10-26
CID: 11004853

5767. CHEMBL526656; BDBM14019; Macrocyclic 3-Aminopyrrolidinone analog 79 ...
MW:     425.482420 g/mol MF: C25H23N5O2
Create Date: 2006-10-26
CID: 10928028

5768. CHEMBL523570; BDBM14021; Macrocyclic 3-Aminopyrrolidinone analog 81 ...
MW:     425.482420 g/mol MF: C25H23N5O2
Create Date: 2006-10-26
CID: 10906012

5769. CHEMBL524082; BDBM14013; Macrocyclic 3-Aminopyrrolidinone analog 57 ...
MW:     463.487340 g/mol MF: C27H21N5O3
Create Date: 2006-10-26
CID: 10895869

5770. CHEMBL498101; BDBM14020; Macrocyclic 3-Aminopyrrolidinone analog 80 ...
MW:     425.482420 g/mol MF: C25H23N5O2
Create Date: 2006-10-26
CID: 10884405

5771. CHEMBL498100; BDBM14017; Macrocyclic 3-Aminopyrrolidinone analog 69 ...
MW:     463.530400 g/mol MF: C28H25N5O2
Create Date: 2006-10-26
CID: 10874250

5772. CHEMBL389643; BDBM18245; Pyrrolo[2, 3-d]pyrimidine analogue, 1a ...
MW:     444.464300 g/mol MF: C19H20N6O5S
IUPAC name: (2S)-2-[[4-[(2,4-diamino-5-methyl-7H-pyrrolo[2,3-d]pyrimidin...
Create Date: 2006-10-25
CID: 10433577

5773. CHEMBL88520; GTPL8629; SCHEMBL1844690 ...
MW:     462.539260 g/mol MF: C23H34N4O6
IUPAC name: (3S,6R,7S)-7-N-hydroxy-3-N-[2-(methylamino)-2-oxoethyl]-6-(2...
Create Date: 2006-10-25
CID: 10344307

5774. SCHEMBL6706055; BDBM59228; SNRXVLSZRFITBF-UHFFFAOYSA-N ...
MW:     477.770860 g/mol MF: C22H19Cl3N4O2
IUPAC name: 6-[(4-methoxyphenyl)methyl]-3-propan-2-yl-1-(2,4,6-trichloro...
Create Date: 2006-10-25
CID: 10310962

5775. CHEMBL310529; SCHEMBL6586594; BDBM10133 ...
MW:     360.359523 g/mol MF: C17H13FN2O4S
IUPAC name: 6-fluoro-5-(2-hydroxyethylsulfonyl)-3-(1H-pyrrol-2-yl)-1H-be...
Create Date: 2006-10-25
CID: 10291997

5776. CHEMBL309767; SCHEMBL6586161; BDBM10134 ...
MW:     359.374763 g/mol MF: C17H14FN3O3S
IUPAC name: 5-(2-aminoethylsulfonyl)-6-fluoro-3-(1H-pyrrol-2-yl)-1H-benz...
Create Date: 2006-10-25
CID: 10269818

5777. CHEMBL314260; GTPL5584; IN 3 ...
MW:     562.787340 g/mol MF: C37H46N4O
IUPAC name: 1-(3-azabicyclo[2.2.2]octan-3-yl)-2-[2-(3,5-dimethylphenyl)-...
Create Date: 2006-10-25
CID: 10231401

5778. CHEMBL438664; BDBM18246; Pyrrolo[2, 3-d]pyrimidine analogue, 2 ...
MW:     458.490880 g/mol MF: C20H22N6O5S
IUPAC name: (2S)-2-[[4-[(2,4-diamino-5-ethyl-7H-pyrrolo[2,3-d]pyrimidin-...
Create Date: 2006-10-25
CID: 10072852

5779. GTPL6124; 2-(4-methylphenyl)-6,7-dihydro-5H-1,4-dithiepine 1,1,4,4-tetraoxide; dithiipin-1,1,4,4-tetroxide analogue 7 ...
MW:     286.367160 g/mol MF: C12H14O4S2
IUPAC name: 2-(4-methylphenyl)-6,7-dihydro-5H-1,4-dithiepine 1,1,4,4-tet...
Create Date: 2006-10-25
CID: 9947811

5780. CHEMBL516874; BDBM14025; Macrocyclic 3-Aminopyrrolidinone analog 85 ...
MW:     441.481820 g/mol MF: C25H23N5O3
Create Date: 2006-10-25
CID: 9932974

5781. CHEMBL53821; BDBM14009; Macrocyclic 3-Aminopyrrolidinone analog 49 ...
MW:     435.477240 g/mol MF: C26H21N5O2
Create Date: 2006-10-25
CID: 9932679

5782. CHEMBL526093; CHEMBL526466; BDBM14018 ...
MW:     425.482420 g/mol MF: C25H23N5O2
Create Date: 2006-10-25
CID: 9867098

5783. CHEMBL381043; SCHEMBL1810535; BDBM16113 ...
MW:     323.365720 g/mol MF: C18H13NO3S
IUPAC name: 3-[(4-phenylphenyl)carbamoyl]thiophene-2-carboxylic acid
Create Date: 2006-10-25
CID: 9861992

5784. CHEMBL498260; BDBM14015; Macrocyclic 3-Aminopyrrolidinone analog 67 ...
MW:     449.503820 g/mol MF: C27H23N5O2
Create Date: 2006-10-25
CID: 9846543

5785. CHEMBL502560; BDBM13998; Macrocyclic 3-Aminopyrrolidinone analog 11 ...
MW:     399.445140 g/mol MF: C23H21N5O2
Create Date: 2006-10-25
CID: 9843867

5786. AC1OCA9L; SCHEMBL2032967; BDBM14395 ...
MW:     440.538580 g/mol MF: C23H32N6O3
IUPAC name: 5-[2-butoxy-5-(1-hydroxyethyl)pyridin-3-yl]-3-ethyl-2-(1-eth...
Create Date: 2006-07-13
CID: 6914589

5787. GSK5182; GSK 5182; GSK-5182 ...
MW:     417.539940 g/mol MF: C27H31NO3
IUPAC name: 4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]-5-hydroxy-2-phe...
Create Date: 2006-06-14
CID: 6852176

5788. CHEMBL331986; 6-(2,5-dimethoxyphenyl)sulfanyl-5-methyl-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine; AC1NX3PA ...
MW:     331.392780 g/mol MF: C15H17N5O2S
IUPAC name: 6-(2,5-dimethoxyphenyl)sulfanyl-5-methyl-7H-pyrrolo[2,3-d]py...
Create Date: 2005-08-01
CID: 5742623

5789. CHEMBL123892; 6-(4-methoxyphenyl)sulfanyl-5-methyl-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine; AC1NX3P6 ...
MW:     301.366800 g/mol MF: C14H15N5OS
IUPAC name: 6-(4-methoxyphenyl)sulfanyl-5-methyl-7H-pyrrolo[2,3-d]pyrimi...
Create Date: 2005-08-01
CID: 5742621

5790. CHEMBL420172; 6-(4-chlorophenyl)sulfanyl-5-methyl-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine; AC1NX3P2 ...
MW:     305.785880 g/mol MF: C13H12ClN5S
IUPAC name: 6-(4-chlorophenyl)sulfanyl-5-methyl-7H-pyrrolo[2,3-d]pyrimid...
Create Date: 2005-08-01
CID: 5742619

5791. CHEMBL334198; 6-(3-chlorophenyl)sulfanyl-5-methyl-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine; AC1NX3P0 ...
MW:     305.785880 g/mol MF: C13H12ClN5S
IUPAC name: 6-(3-chlorophenyl)sulfanyl-5-methyl-7H-pyrrolo[2,3-d]pyrimid...
Create Date: 2005-08-01
CID: 5742618

5792. AC1NUV26; NVP-AMK640; CHEMBL191122 ...
MW:     642.741500 g/mol MF: C29H50N6O10
IUPAC name: (4S)-4-amino-5-[[(2S)-1-[[(2S)-4-amino-1-[[(1S,2S)-1-[(1R,2R...
Create Date: 2006-03-01
CID: 5494406

5793. AC1NS3KH; BDBM3252; Balanol Benzophenone Ester Analog (-)8 ...
MW:     523.488100 g/mol MF: C27H25NO10
IUPAC name: [(1R,2R)-2-[(4-hydroxybenzoyl)amino]cyclopentyl] 3,5-dihydro...
Create Date: 2006-01-30
CID: 5328011

5794. CHEMBL55826; 1ld7; BDBM14014 ...
MW:     449.503820 g/mol MF: C27H23N5O2
Create Date: 2005-06-24
CID: 5326625

5795. PETT; Thiourea, N-(2-phenylethyl)-N'-2-thiazolyl-; LY73497 ...
MW:     263.381720 g/mol MF: C12H13N3S2
IUPAC name: 1-(2-phenylethyl)-3-(1,3-thiazol-2-yl)thiourea
Create Date: 2005-08-01
CID: 3001082

5796. AC1MHDFA; CHEMBL111945; Isoquinoline furanyl urethane analog. 13
MW:     571.747960 g/mol MF: C32H49N3O6
IUPAC name: [(3R,3aS,5R,6aS)-5-methyl-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]...
Create Date: 2005-08-01
CID: 3000858

5797. AC1MHD56; BDBM1351; CHEMBL124557 ...
MW:     308.440500 g/mol MF: C19H20N2S
IUPAC name: 5-ethyl-6-methyl-3-(naphthalen-2-ylmethylamino)-1H-pyridine-...
Create Date: 2005-08-01
CID: 3000382

5798. 3-[(4,7-dichloro-1,3-benzoxazol-2-yl)methylamino]-5-ethyl-6-methyl-1H-pyridine-2-thione; AC1MHD55; BDBM1339 ...
MW:     368.280800 g/mol MF: C16H15Cl2N3OS
IUPAC name: 3-[(4,7-dichloro-1,3-benzoxazol-2-yl)methylamino]-5-ethyl-6-...
Create Date: 2005-08-01
CID: 3000381

5799. Acetamide, N-(3-methylphenyl)-N-[1-(2-phenylethyl)-4-piperidinyl]-; 1640-10-4; AC1LDBVX ...
MW:     336.470520 g/mol MF: C22H28N2O
IUPAC name: N-(3-methylphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]acetam...
Create Date: 2005-03-27
CID: 615724

5800. AC1LALHB; CHEMBL73934; BDBM9307 ...
MW:     700.863480 g/mol MF: C40H52N4O7
IUPAC name: (3S,4aS,8aS)-N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-[[(2S)-2-[(...
Create Date: 2005-08-01
CID: 515902

5801. AC1LALH8; BDBM9306; CHEMBL309175 ...
MW:     672.853380 g/mol MF: C39H52N4O6
IUPAC name: (3S,4aS,8aS)-N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-[[(2S)-3-me...
Create Date: 2005-08-01
CID: 515901

5802. AC1LALH5; CHEMBL75904; BDBM9305 ...
MW:     712.321560 g/mol MF: C37H54ClN7O5
IUPAC name: (3S,4aS,8aS)-N-tert-butyl-2-[(2R,3S)-3-[[(2S)-2-[[6-chloro-5...
Create Date: 2005-08-01
CID: 515900

5803. AC1LALH2; BDBM9304; CHEMBL432924 ...
MW:     727.336200 g/mol MF: C37H55ClN8O5
IUPAC name: (3S,4aS,8aS)-2-[(2R,3S)-3-[[(2S)-2-[[3-amino-6-chloro-5-(dim...
Create Date: 2005-08-01
CID: 515899

5804. AC1LALGZ; BDBM9308; CHEMBL265026 ...
MW:     634.808700 g/mol MF: C35H50N6O5
IUPAC name: (3S,4aS,8aS)-N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-[[(2S)-2-[(...
Create Date: 2005-08-01
CID: 515898

5805. AC1LALGW; BDBM9303; CHEMBL307918 ...
MW:     684.867380 g/mol MF: C39H52N6O5
IUPAC name: N-[(1S)-2-[[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)-...
Create Date: 2005-08-01
CID: 515897

5806. AC1LALGT; CHEMBL74472; BDBM9302 ...
MW:     656.857280 g/mol MF: C38H52N6O4
IUPAC name: N-[(2S)-1-[[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)-...
Create Date: 2005-08-01
CID: 515896

5807. AC1LALGQ; BDBM9301; CHEMBL306974 ...
MW:     714.294380 g/mol MF: C36H52ClN7O6
IUPAC name: methyl 5-[[(1S)-2-[[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcar...
Create Date: 2005-08-01
CID: 515895

5808. AC1LALGK; BDBM9299; CHEMBL418902 ...
MW:     697.905900 g/mol MF: C41H55N5O5
IUPAC name: N-[(1S)-2-[[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)-...
Create Date: 2005-08-01
CID: 515893

5809. AC1LALGH; BDBM9298; CHEMBL306810 ...
MW:     731.943720 g/mol MF: C40H53N5O6S
IUPAC name: N-[(1S)-2-[[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)-...
Create Date: 2005-08-01
CID: 515892

5810. AC1LALGE; CHEMBL76352; BDBM9297 ...
MW:     731.943720 g/mol MF: C40H53N5O6S
IUPAC name: N-[(1S)-2-[[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)-...
Create Date: 2005-08-01
CID: 515891

5811. AC1LALGB; CHEMBL74077; BDBM9296 ...
MW:     699.944920 g/mol MF: C40H53N5O4S
IUPAC name: N-[(1S)-2-[[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)-...
Create Date: 2005-08-01
CID: 515890

5812. AC1LALG8; BDBM9295; CHEMBL306570 ...
MW:     699.944920 g/mol MF: C40H53N5O4S
IUPAC name: N-[(1S)-2-[[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)-...
Create Date: 2005-08-01
CID: 515889

5813. AC1LALG5; BDBM9293; CHEMBL307926 ...
MW:     681.906500 g/mol MF: C41H55N5O4
IUPAC name: N-[(1S)-2-[[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)-...
Create Date: 2005-08-01
CID: 515888

5814. (3R,4R,5S)-4-acetamido-5-amino-3-[(2R)-2-(hydroxymethyl)azepan-1-yl]cyclohexene-1-carboxylic acid; AC1LA2NR; CHEMBL25549 ...
MW:     325.403280 g/mol MF: C16H27N3O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-[(2R)-2-(hydroxymethyl)azep...
Create Date: 2005-08-01
CID: 506121

5815. (3R,4R,5S)-4-acetamido-5-amino-3-(8-azabicyclo[3.2.1]octan-8-yl)cyclohexene-1-carboxylic acid; AC1LA2NO; CHEMBL22808 ...
MW:     307.388000 g/mol MF: C16H25N3O3
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-(8-azabicyclo[3.2.1]octan-8...
Create Date: 2005-08-01
CID: 506120

5816. AC1LA2NL; CHEMBL22943; BDBM5261 ...
MW:     323.430460 g/mol MF: C17H29N3O3
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-(4-propylpiperidin-1-yl)cyc...
Create Date: 2005-08-01
CID: 506119

5817. AC1LA2NI; CHEMBL25333; BDBM5260 ...
MW:     309.403880 g/mol MF: C16H27N3O3
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-(4-ethylpiperidin-1-yl)cycl...
Create Date: 2005-08-01
CID: 506118

5818. AC1LA2NF; CHEMBL25495; BDBM5259 ...
MW:     295.377300 g/mol MF: C15H25N3O3
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-(4-methylpiperidin-1-yl)cyc...
Create Date: 2005-08-01
CID: 506117

5819. (3R,4R,5S)-4-acetamido-5-amino-3-(4-methylpiperazin-1-yl)cyclohexene-1-carboxylic acid; AC1LA2NC; BDBM5258 ...
MW:     296.365360 g/mol MF: C14H24N4O3
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-(4-methylpiperazin-1-yl)cyc...
Create Date: 2005-08-01
CID: 506116

5820. AC1LA2N9; CHEMBL22803; BDBM5257 ...
MW:     283.323540 g/mol MF: C13H21N3O4
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-morpholin-4-ylcyclohexene-1...
Create Date: 2005-08-01
CID: 506115

5821. (3R,4R,5S)-4-acetamido-5-amino-3-(3,3-diethylazetidin-1-yl)cyclohexene-1-carboxylic acid; AC1LA2N6; CHEMBL22349 ...
MW:     309.403880 g/mol MF: C16H27N3O3
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-(3,3-diethylazetidin-1-yl)c...
Create Date: 2005-08-01
CID: 506114

5822. (3R,4R,5S)-4-acetamido-5-amino-3-(azonan-1-yl)cyclohexene-1-carboxylic acid; AC1LA2N3; BDBM5255 ...
MW:     323.430460 g/mol MF: C17H29N3O3
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-(azonan-1-yl)cyclohexene-1-...
Create Date: 2005-08-01
CID: 506113

5823. (3R,4R,5S)-4-acetamido-5-amino-3-(azocan-1-yl)cyclohexene-1-carboxylic acid; AC1LA2N0; CHEMBL22350 ...
MW:     309.403880 g/mol MF: C16H27N3O3
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-(azocan-1-yl)cyclohexene-1-...
Create Date: 2005-08-01
CID: 506112

5824. (3R,4R,5S)-4-acetamido-5-amino-3-(azepan-1-yl)cyclohexene-1-carboxylic acid; AC1LA2MX; BDBM5253 ...
MW:     295.377300 g/mol MF: C15H25N3O3
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-(azepan-1-yl)cyclohexene-1-...
Create Date: 2005-08-01
CID: 506111

5825. AC1LA2MU; CHEMBL23009; BDBM5252 ...
MW:     281.350720 g/mol MF: C14H23N3O3
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-piperidin-1-ylcyclohexene-1...
Create Date: 2005-08-01
CID: 506110

5826. AC1LA2MR; BDBM5251; CHEMBL280383 ...
MW:     267.324140 g/mol MF: C13H21N3O3
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-pyrrolidin-1-ylcyclohexene-...
Create Date: 2005-08-01
CID: 506109

5827. (3R,4R,5S)-4-acetamido-5-amino-3-(azetidin-1-yl)cyclohexene-1-carboxylic acid; AC1LA2MO; BDBM5250 ...
MW:     253.297560 g/mol MF: C12H19N3O3
IUPAC name: (3R,4R,5S)-4-acetamido-5-amino-3-(azetidin-1-yl)cyclohexene-...
Create Date: 2005-08-01
CID: 506108

5828. 210355-05-8; (Z)-2-Amino-6-cyclopropylamino-9-(2-hydroxymethylcyclopropylidenemethyl)purine; AC1LAJZ4 ...
MW:     272.305740 g/mol MF: C13H16N6O
IUPAC name: [2-[[2-amino-6-(cyclopropylamino)purin-9-yl]methylidene]cycl...
Create Date: 2005-08-01
CID: 469803

5829. AC1LAADZ; CHEMBL75082; BDBM9294 ...
MW:     655.869220 g/mol MF: C39H53N5O4
IUPAC name: N-[(2S)-1-[[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)-...
Create Date: 2005-08-01
CID: 464721

5830. AC1LA88Q; Dipyridodiazepinone deriv. 32; BDBM1543 ...
MW:     355.457240 g/mol MF: C18H21N5OS
IUPAC name: 11-ethyl-4-methyl-2-thiomorpholin-4-yl-5H-dipyrido[2,3-b:2',...
Create Date: 2005-08-01
CID: 463552

5831. AC1LA3G6; CHEMBL109273; Isoquinoline furanyl urethane analog. 10
MW:     557.721380 g/mol MF: C31H47N3O6
IUPAC name: [(3R,3aR,6aR)-2,3,3a,4,6,6a-hexahydrofuro[3,4-b]furan-3-yl] ...
Create Date: 2005-08-01
CID: 461025

5832. CHEMBL287511; 6-[2-(2,5-dimethoxyphenyl)ethyl]pteridine-2,4-diamine; Nair # 7 ...
MW:     326.353120 g/mol MF: C16H18N6O2
IUPAC name: 6-[2-(2,5-dimethoxyphenyl)ethyl]pteridine-2,4-diamine
Create Date: 2005-08-01
CID: 456302

5833. AC1L9RNO; BDBM1330; CHEMBL125120 ...
MW:     296.363600 g/mol MF: C18H20N2O2
IUPAC name: 5-ethyl-6-methyl-3-[(3-methyl-1-benzofuran-2-yl)methylamino]...
Create Date: 2005-08-01
CID: 454453

5834. AC1L9RNN; BDBM1329; CHEMBL123553 ...
MW:     316.782080 g/mol MF: C17H17ClN2O2
IUPAC name: 3-[(7-chloro-1-benzofuran-2-yl)methylamino]-5-ethyl-6-methyl...
Create Date: 2005-08-01
CID: 454452

5835. AC1L9RNM; BDBM1328; CHEMBL123636 ...
MW:     351.227140 g/mol MF: C17H16Cl2N2O2
IUPAC name: 3-[(4,7-dichloro-1-benzofuran-2-yl)methylamino]-5-ethyl-6-me...
Create Date: 2005-08-01
CID: 454451

5836. AC1L9RNB; BDBM1353; CHEMBL123729 ...
MW:     300.353840 g/mol MF: C20H16N2O
IUPAC name: 3-(naphthalen-2-ylmethylamino)-1H-quinolin-2-one
Create Date: 2005-08-01
CID: 454440

5837. AC1L9RNA; BDBM1352; CHEMBL122978 ...
MW:     306.401480 g/mol MF: C20H22N2O
IUPAC name: 5-ethyl-1,6-dimethyl-3-(naphthalen-2-ylmethylamino)pyridin-2...
Create Date: 2005-08-01
CID: 454439

5838. 3-(1,3-benzoxazol-2-ylmethylamino)-6-methyl-5-methylsulfinyl-1H-pyridin-2-one; AC1L9RN9; BDBM1350 ...
MW:     317.362900 g/mol MF: C15H15N3O3S
IUPAC name: 3-(1,3-benzoxazol-2-ylmethylamino)-6-methyl-5-methylsulfinyl...
Create Date: 2005-08-01
CID: 454437

5839. ethyl 5-(1,3-benzoxazol-2-ylmethylamino)-2-methyl-6-oxo-1H-pyridine-3-carboxylate; AC1L9RN8; BDBM1349 ...
MW:     327.334580 g/mol MF: C17H17N3O4
IUPAC name: ethyl 5-(1,3-benzoxazol-2-ylmethylamino)-2-methyl-6-oxo-1H-p...
Create Date: 2005-08-01
CID: 454436

5840. 3-(1,3-benzoxazol-2-ylmethylamino)-6-methyl-5-methylsulfonyl-1H-pyridin-2-one; AC1L9RN7; BDBM1348 ...
MW:     333.362300 g/mol MF: C15H15N3O4S
IUPAC name: 3-(1,3-benzoxazol-2-ylmethylamino)-6-methyl-5-methylsulfonyl...
Create Date: 2005-08-01
CID: 454435

5841. 3-(1,3-benzoxazol-2-ylmethylamino)-5-ethyl-4,6-dimethyl-1H-pyridin-2-one; AC1L9RN6; BDBM1347 ...
MW:     297.351660 g/mol MF: C17H19N3O2
IUPAC name: 3-(1,3-benzoxazol-2-ylmethylamino)-5-ethyl-4,6-dimethyl-1H-p...
Create Date: 2005-08-01
CID: 454434

5842. 3-(1,3-benzoxazol-2-ylmethylamino)-5-ethylsulfanyl-6-methyl-1H-pyridin-2-one; AC1L9RN5; BDBM1346 ...
MW:     315.390080 g/mol MF: C16H17N3O2S
IUPAC name: 3-(1,3-benzoxazol-2-ylmethylamino)-5-ethylsulfanyl-6-methyl-...
Create Date: 2005-08-01
CID: 454433

5843. 3-(1,3-benzoxazol-2-ylmethylamino)-6-methyl-5-methylsulfanyl-1H-pyridin-2-one; AC1L9RN4; BDBM1345 ...
MW:     301.363500 g/mol MF: C15H15N3O2S
IUPAC name: 3-(1,3-benzoxazol-2-ylmethylamino)-6-methyl-5-methylsulfanyl...
Create Date: 2005-08-01
CID: 454432

5844. 3-[(4,7-dichloro-1,3-benzoxazol-2-yl)methylamino]-4,6-dimethyl-1H-pyridin-2-one; AC1L9RN3; BDBM1344 ...
MW:     338.188620 g/mol MF: C15H13Cl2N3O2
IUPAC name: 3-[(4,7-dichloro-1,3-benzoxazol-2-yl)methylamino]-4,6-dimeth...
Create Date: 2005-08-01
CID: 454431

5845. 3-[(4,7-dichloro-1,3-benzoxazol-2-yl)methylamino]-5-(1-hydroxyethyl)-6-methyl-1H-pyridin-2-one; AC1L9RN2; BDBM1343 ...
MW:     368.214600 g/mol MF: C16H15Cl2N3O3
IUPAC name: 3-[(4,7-dichloro-1,3-benzoxazol-2-yl)methylamino]-5-(1-hydro...
Create Date: 2005-08-01
CID: 454430

5846. 5-acetyl-3-[(4,7-dichloro-1,3-benzoxazol-2-yl)methylamino]-6-methyl-1H-pyridin-2-one; AC1L9RN1; BDBM1342 ...
MW:     366.198720 g/mol MF: C16H13Cl2N3O3
IUPAC name: 5-acetyl-3-[(4,7-dichloro-1,3-benzoxazol-2-yl)methylamino]-6...
Create Date: 2005-08-01
CID: 454429

5847. AC1L9RN0; BDBM1336; CHEMBL124991 ...
MW:     306.401480 g/mol MF: C20H22N2O
IUPAC name: 5-ethyl-6-methyl-3-(1-naphthalen-2-ylethylamino)-1H-pyridin-...
Create Date: 2005-08-01
CID: 454428

5848. 3-[(4,7-dichloro-1,3-benzoxazol-2-yl)methylamino]-6-methyl-5-methylsulfanyl-1H-pyridin-2-one; AC1L9RMZ; BDBM1338 ...
MW:     370.253620 g/mol MF: C15H13Cl2N3O2S
IUPAC name: 3-[(4,7-dichloro-1,3-benzoxazol-2-yl)methylamino]-6-methyl-5...
Create Date: 2005-08-01
CID: 454427

5849. 3-[(4,7-dichloro-1,3-benzoxazol-2-yl)methylamino]-5-methoxy-6-methyl-1H-pyridin-2-one; AC1L9RMY; BDBM1341 ...
MW:     354.188020 g/mol MF: C15H13Cl2N3O3
IUPAC name: 3-[(4,7-dichloro-1,3-benzoxazol-2-yl)methylamino]-5-methoxy-...
Create Date: 2005-08-01
CID: 454425

5850. 5-[(4,7-dichloro-1,3-benzoxazol-2-yl)methylamino]-2-methyl-3-azabicyclo[4.1.0]hepta-1,5-dien-4-one; AC1L9RMX; BDBM1340 ...
MW:     336.172740 g/mol MF: C15H11Cl2N3O2
IUPAC name: 5-[(4,7-dichloro-1,3-benzoxazol-2-yl)methylamino]-2-methyl-3...
Create Date: 2005-08-01
CID: 454424

5851. AC1L9RMW; BDBM1337; CHEMBL339203 ...
MW:     350.199320 g/mol MF: C16H13Cl2N3O2
IUPAC name: 3-[(4,7-dichloro-1,3-benzoxazol-2-yl)methylamino]-5-ethenyl-...
Create Date: 2005-08-01
CID: 454423

5852. AC1L9RMV; BDBM1335; CHEMBL124992 ...
MW:     365.253720 g/mol MF: C18H18Cl2N2O2
IUPAC name: 3-[(4,7-dichloro-1-benzofuran-2-yl)methyl-methylamino]-5-eth...
Create Date: 2005-08-01
CID: 454422

5853. AC1L9RMU; BDBM1334; CHEMBL338872 ...
MW:     296.363600 g/mol MF: C18H20N2O2
IUPAC name: 3-[1-(1-benzofuran-2-yl)ethylamino]-5-ethyl-6-methyl-1H-pyri...
Create Date: 2005-08-01
CID: 454421

5854. AC1L9RMT; BDBM1333; CHEMBL124430 ...
MW:     325.404820 g/mol MF: C19H23N3O2
IUPAC name: 3-[(4,7-dimethyl-1,3-benzoxazol-2-yl)methyl-methylamino]-5-e...
Create Date: 2005-08-01
CID: 454420

5855. AC1L9RMS; BDBM1332; CHEMBL126214 ...
MW:     380.268360 g/mol MF: C18H19Cl2N3O2
IUPAC name: 3-[(4,7-dichloro-1,3-benzoxazol-2-yl)methyl-ethylamino]-5-et...
Create Date: 2005-08-01
CID: 454419

5856. AC1L9RMR; BDBM1331; CHEMBL125232 ...
MW:     366.241780 g/mol MF: C17H17Cl2N3O2
IUPAC name: 3-[(4,7-dichloro-1,3-benzoxazol-2-yl)methyl-methylamino]-5-e...
Create Date: 2005-08-01
CID: 454418

5857. 3-[[(4-Aminobenzoxazol-2-yl)methyl]amino]-5-ethyl-6-methylpyridin-2(1H)-one; 3-[(4-amino-1,3-benzoxazol-2-yl)methylamino]-5-ethyl-6-methyl-1H-pyridin-2-one; AC1L9RMQ ...
MW:     298.339720 g/mol MF: C16H18N4O2
IUPAC name: 3-[(4-amino-1,3-benzoxazol-2-yl)methylamino]-5-ethyl-6-methy...
Create Date: 2005-08-01
CID: 454417

5858. 5-ethyl-6-methyl-3-[(4-nitro-1,3-benzoxazol-2-yl)methylamino]-1H-pyridin-2-one; AC1L9RMP; BDBM1326 ...
MW:     328.322640 g/mol MF: C16H16N4O4
IUPAC name: 5-ethyl-6-methyl-3-[(4-nitro-1,3-benzoxazol-2-yl)methylamino...
Create Date: 2005-08-01
CID: 454416

5859. 5-ethyl-3-[(4-hydroxy-1,3-benzoxazol-2-yl)methylamino]-6-methyl-1H-pyridin-2-one; AC1L9RMO; BDBM1325 ...
MW:     299.324480 g/mol MF: C16H17N3O3
IUPAC name: 5-ethyl-3-[(4-hydroxy-1,3-benzoxazol-2-yl)methylamino]-6-met...
Create Date: 2005-08-01
CID: 454415

5860. 5-ethyl-3-[(4-methoxy-1,3-benzoxazol-2-yl)methylamino]-6-methyl-1H-pyridin-2-one; AC1L9RMN; BDBM1324 ...
MW:     313.351060 g/mol MF: C17H19N3O3
IUPAC name: 5-ethyl-3-[(4-methoxy-1,3-benzoxazol-2-yl)methylamino]-6-met...
Create Date: 2005-08-01
CID: 454414

5861. 3-[(4,7-difluoro-1,3-benzoxazol-2-yl)methylamino]-5-ethyl-6-methyl-1H-pyridin-2-one; AC1L9RMM; BDBM1323 ...
MW:     319.306006 g/mol MF: C16H15F2N3O2
IUPAC name: 3-[(4,7-difluoro-1,3-benzoxazol-2-yl)methylamino]-5-ethyl-6-...
Create Date: 2005-08-01
CID: 454413

5862. 3-[(7-chloro-4-fluoro-1,3-benzoxazol-2-yl)methylamino]-5-ethyl-6-methyl-1H-pyridin-2-one; AC1L9RML; BDBM1322 ...
MW:     335.760603 g/mol MF: C16H15ClFN3O2
IUPAC name: 3-[(7-chloro-4-fluoro-1,3-benzoxazol-2-yl)methylamino]-5-eth...
Create Date: 2005-08-01
CID: 454412

5863. 139548-49-5; 2(1H)-Pyridinone, 5-ethyl-3-(((7-fluoro-2-benzoxazolyl)methyl)amino)-6-methyl-; 5-ethyl-3-[(7-fluoro-1,3-benzoxazol-2-yl)methylamino]-6-methyl-1H-pyridin-2-one ...
MW:     301.315543 g/mol MF: C16H16FN3O2
IUPAC name: 5-ethyl-3-[(7-fluoro-1,3-benzoxazol-2-yl)methylamino]-6-meth...
Create Date: 2005-08-01
CID: 454411

5864. 143708-06-9; 2(1H)-Pyridinone, 5-ethyl-3-(((6-fluoro-2-benzoxazolyl)methyl)amino)-6-methyl-; 5-ethyl-3-[(6-fluoro-1,3-benzoxazol-2-yl)methylamino]-6-methyl-1H-pyridin-2-one ...
MW:     301.315543 g/mol MF: C16H16FN3O2
IUPAC name: 5-ethyl-3-[(6-fluoro-1,3-benzoxazol-2-yl)methylamino]-6-meth...
Create Date: 2005-08-01
CID: 454410

5865. 143708-05-8; 2(1H)-Pyridinone, 5-ethyl-3-(((5-fluoro-2-benzoxazolyl)methyl)amino)-6-methyl-; 5-ethyl-3-[(5-fluoro-1,3-benzoxazol-2-yl)methylamino]-6-methyl-1H-pyridin-2-one ...
MW:     301.315543 g/mol MF: C16H16FN3O2
IUPAC name: 5-ethyl-3-[(5-fluoro-1,3-benzoxazol-2-yl)methylamino]-6-meth...
Create Date: 2005-08-01
CID: 454409

5866. 139571-98-5; 2(1H)-Pyridinone, 5-ethyl-3-(((4-fluoro-2-benzoxazolyl)methyl)amino)-6-methyl-; 5-ethyl-3-[(4-fluoro-1,3-benzoxazol-2-yl)methylamino]-6-methyl-1H-pyridin-2-one ...
MW:     301.315543 g/mol MF: C16H16FN3O2
IUPAC name: 5-ethyl-3-[(4-fluoro-1,3-benzoxazol-2-yl)methylamino]-6-meth...
Create Date: 2005-08-01
CID: 454408

5867. 139548-35-9; 2(1H)-Pyridinone, 3-(((7-chloro-2-benzoxazolyl)methyl)amino)-5-ethyl-6-methyl-; 3-[(7-chloro-1,3-benzoxazol-2-yl)methylamino]-5-ethyl-6-methyl-1H-pyridin-2-one ...
MW:     317.770140 g/mol MF: C16H16ClN3O2
IUPAC name: 3-[(7-chloro-1,3-benzoxazol-2-yl)methylamino]-5-ethyl-6-meth...
Create Date: 2005-08-01
CID: 454407

5868. 139548-50-8; 2(1H)-Pyridinone, 3-(((4-chloro-2-benzoxazolyl)methyl)amino)-5-ethyl-6-methyl-; 3-[(4-chloro-1,3-benzoxazol-2-yl)methylamino]-5-ethyl-6-methyl-1H-pyridin-2-one ...
MW:     317.770140 g/mol MF: C16H16ClN3O2
IUPAC name: 3-[(4-chloro-1,3-benzoxazol-2-yl)methylamino]-5-ethyl-6-meth...
Create Date: 2005-08-01
CID: 454406

5869. 143708-04-7; 2(1H)-Pyridinone, 5-ethyl-3-(((7-ethyl-2-benzoxazolyl)methyl)amino)-6-methyl-; 5-ethyl-3-[(7-ethyl-1,3-benzoxazol-2-yl)methylamino]-6-methyl-1H-pyridin-2-one ...
MW:     311.378240 g/mol MF: C18H21N3O2
IUPAC name: 5-ethyl-3-[(7-ethyl-1,3-benzoxazol-2-yl)methylamino]-6-methy...
Create Date: 2005-08-01
CID: 454405

5870. 143708-03-6; 3-((6-Methyl-benzoxazol-2-ylmethyl)amino)-5-ethyl-6-methylpyridin-2(1H)-one; 5-ethyl-6-methyl-3-[(6-methyl-1,3-benzoxazol-2-yl)methylamino]-1H-pyridin-2-one ...
MW:     297.351660 g/mol MF: C17H19N3O2
IUPAC name: 5-ethyl-6-methyl-3-[(6-methyl-1,3-benzoxazol-2-yl)methylamin...
Create Date: 2005-08-01
CID: 454404

5871. 143708-02-5; 2(1H)-Pyridinone, 5-ethyl-6-methyl-3-(((5-methyl-2-benzoxazolyl)methyl)amino)-; 5-ethyl-6-methyl-3-[(5-methyl-1,3-benzoxazol-2-yl)methylamino]-1H-pyridin-2-one ...
MW:     297.351660 g/mol MF: C17H19N3O2
IUPAC name: 5-ethyl-6-methyl-3-[(5-methyl-1,3-benzoxazol-2-yl)methylamin...
Create Date: 2005-08-01
CID: 454403

5872. CHEMBL125702; 143708-00-3; 2(1H)-Pyridinone, 5-ethyl-3-((3-furanylmethyl)amino)-6-methyl- ...
MW:     232.278340 g/mol MF: C13H16N2O2
IUPAC name: 5-ethyl-3-(furan-3-ylmethylamino)-6-methyl-1H-pyridin-2-one
Create Date: 2005-08-01
CID: 454402

5873. CHEMBL123968; 143707-99-7; 5-ethyl-3-(furo[2,3-c]pyridin-2-ylmethylamino)-6-methyl-1H-pyridin-2-one ...
MW:     283.325080 g/mol MF: C16H17N3O2
IUPAC name: 5-ethyl-3-(furo[2,3-c]pyridin-2-ylmethylamino)-6-methyl-1H-p...
Create Date: 2005-08-01
CID: 454401

5874. CHEMBL123735; 143707-98-6; 5-ethyl-3-(furo[3,2-c]pyridin-2-ylmethylamino)-6-methyl-1H-pyridin-2-one ...
MW:     283.325080 g/mol MF: C16H17N3O2
IUPAC name: 5-ethyl-3-(furo[3,2-c]pyridin-2-ylmethylamino)-6-methyl-1H-p...
Create Date: 2005-08-01
CID: 454400

5875. CHEMBL338129; 143707-97-5; 2(1H)-Pyridinone, 5-ethyl-3-((2-furanylmethyl)amino)-6-methyl- ...
MW:     232.278340 g/mol MF: C13H16N2O2
IUPAC name: 5-ethyl-3-(furan-2-ylmethylamino)-6-methyl-1H-pyridin-2-one
Create Date: 2005-08-01
CID: 454399

5876. CHEMBL340255; 143707-96-4; 5-ethyl-3-(1H-indol-3-ylmethylamino)-6-methyl-1H-pyridin-2-one ...
MW:     281.352260 g/mol MF: C17H19N3O
IUPAC name: 5-ethyl-3-(1H-indol-3-ylmethylamino)-6-methyl-1H-pyridin-2-o...
Create Date: 2005-08-01
CID: 454398

5877. CHEMBL339138; 143707-95-3; 2(1H)-Pyridinone, 5-ethyl-6-methyl-3-((2-pyridinylmethyl)amino)- ...
MW:     243.304280 g/mol MF: C14H17N3O
IUPAC name: 5-ethyl-6-methyl-3-(pyridin-2-ylmethylamino)-1H-pyridin-2-on...
Create Date: 2005-08-01
CID: 454397

5878. 143707-94-2; 2(1H)-Pyridinone, 5-ethyl-6-methyl-3-((naphth(2,3-d)oxazol-2-ylmethyl)amino)-; 3-(benzo[f][1,3]benzoxazol-2-ylmethylamino)-5-ethyl-6-methyl-1H-pyridin-2-one ...
MW:     333.383760 g/mol MF: C20H19N3O2
IUPAC name: 3-(benzo[f][1,3]benzoxazol-2-ylmethylamino)-5-ethyl-6-methyl...
Create Date: 2005-08-01
CID: 454396

5879. CHEMBL125867; 143707-91-9; 5-ethyl-3-(1H-indol-2-ylmethylamino)-6-methyl-1H-pyridin-2-one ...
MW:     281.352260 g/mol MF: C17H19N3O
IUPAC name: 5-ethyl-3-(1H-indol-2-ylmethylamino)-6-methyl-1H-pyridin-2-o...
Create Date: 2005-08-01
CID: 454395

5880. 143707-90-8; 2(1H)-Pyridinone, 5-ethyl-6-methyl-3-((naphth(1,2-d)oxazol-2-ylmethyl)amino)-; 3-(benzo[e][1,3]benzoxazol-2-ylmethylamino)-5-ethyl-6-methyl-1H-pyridin-2-one ...
MW:     333.383760 g/mol MF: C20H19N3O2
IUPAC name: 3-(benzo[e][1,3]benzoxazol-2-ylmethylamino)-5-ethyl-6-methyl...
Create Date: 2005-08-01
CID: 454394

5881. 143707-89-5; 4(1H)-Quinazolinone, 2-(((5-ethyl-1,2-dihydro-6-methyl-2-oxo-3-pyridinyl)amino)methyl)-; 3-(((4-Oxo-2-quinazolinyl)methyl)amino)-5-ethyl-6-methylpyridin-2(1H)-one ...
MW:     310.350420 g/mol MF: C17H18N4O2
IUPAC name: 2-[[(5-ethyl-6-methyl-2-oxo-1H-pyridin-3-yl)amino]methyl]-1H...
Create Date: 2005-08-01
CID: 454393

5882. 143707-88-4; 2(1H)-Pyridinone, 5-ethyl-6-methyl-3-(((5-phenyl-2-oxazolyl)methyl)amino)-; 2(1H)-Pyridinone, 5-ethyl-6-methyl-3-[[(5-phenyl-2-oxazolyl)methyl]amino]- ...
MW:     309.362360 g/mol MF: C18H19N3O2
IUPAC name: 5-ethyl-6-methyl-3-[(5-phenyl-1,3-oxazol-2-yl)methylamino]-1...
Create Date: 2005-08-01
CID: 454392

5883. CHEMBL125873; 143707-87-3; 2(1H)-Pyridinone, 5-ethyl-6-methyl-3-((1-naphthalenylmethyl)amino)- ...
MW:     292.374900 g/mol MF: C19H20N2O
IUPAC name: 5-ethyl-6-methyl-3-(naphthalen-1-ylmethylamino)-1H-pyridin-2...
Create Date: 2005-08-01
CID: 454391

5884. 143707-86-2; 2(1H)-Pyridinone, 5-ethyl-6-methyl-3-((oxazolo(4,5-b)pyridin-2-ylmethyl)amino)-; 2(1H)-Pyridinone, 5-ethyl-6-methyl-3-[(oxazolo[4,5-b]pyridin-2-ylmethyl)amino]- ...
MW:     284.313140 g/mol MF: C15H16N4O2
IUPAC name: 5-ethyl-6-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-ylmethylami...
Create Date: 2005-08-01
CID: 454390

5885. 143707-85-1; 5-ethyl-6-methyl-3-[(4-oxochromen-3-yl)methylamino]-1H-pyridin-2-one; 2(1H)-Pyridinone, 5-ethyl-6-methyl-3-(((4-oxo-4H-1-benzopyran-3-yl)methyl)amino)- ...
MW:     310.347120 g/mol MF: C18H18N2O3
IUPAC name: 5-ethyl-6-methyl-3-[(4-oxochromen-3-yl)methylamino]-1H-pyrid...
Create Date: 2005-08-01
CID: 454389

5886. CHEMBL123639; 143707-84-0; 2(1H)-Pyridinone, 5-ethyl-6-methyl-3-((2-quinolinylmethyl)amino)- ...
MW:     293.362960 g/mol MF: C18H19N3O
IUPAC name: 5-ethyl-6-methyl-3-(quinolin-2-ylmethylamino)-1H-pyridin-2-o...
Create Date: 2005-08-01
CID: 454388

5887. AC1L9RLQ; BDBM9292; CHEMBL312788 ...
MW:     683.879320 g/mol MF: C40H53N5O5
IUPAC name: N-[(1S)-2-[[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)-...
Create Date: 2005-08-01
CID: 454381

5888. AC1L9RLP; BDBM9291; CHEMBL451129 ...
MW:     683.879320 g/mol MF: C40H53N5O5
IUPAC name: N-[(1S)-2-[[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)-...
Create Date: 2005-08-01
CID: 454380

5889. CHEMBL86064; 3-(benzylamino)-5-ethyl-6-methyl-1H-pyridin-2-one; AC1L9RKU ...
MW:     242.316220 g/mol MF: C15H18N2O
IUPAC name: 3-(benzylamino)-5-ethyl-6-methyl-1H-pyridin-2-one
Create Date: 2005-08-01
CID: 454349

5890. CHEMBL85975; 3-[(3-Pyridylmethyl)amino]-5-ethyl-6-methylpyridin-2(1H)-one; AC1L9RKS ...
MW:     243.304280 g/mol MF: C14H17N3O
IUPAC name: 5-ethyl-6-methyl-3-(pyridin-3-ylmethylamino)-1H-pyridin-2-on...
Create Date: 2005-08-01
CID: 454347

5891. 135525-76-7; 3-((7-Methyl-Benzoxazol-2-ylmethyl)amino)-5-ethyl-6-methlpyridin-2(1H)-one; 3-[(7-Methyl-Benzoxazol-2-ylmethyl)amino]-5-ethyl-6-methlpyridin-2(1H)-one ...
MW:     297.351660 g/mol MF: C17H19N3O2
IUPAC name: 5-ethyl-6-methyl-3-[(7-methyl-1,3-benzoxazol-2-yl)methylamin...
Create Date: 2005-08-01
CID: 453443

5892. 135525-75-6; 3-((4-Methylbenzoxazol-2-ylmethyl)amino)-5-ethyl-6-methlpyridin-2(1H)-one; 3-[(4-Methylbenzoxazol-2-ylmethyl)amino]-5-ethyl-6-methlpyridin-2(1H)-one ...
MW:     297.351660 g/mol MF: C17H19N3O2
IUPAC name: 5-ethyl-6-methyl-3-[(4-methyl-1,3-benzoxazol-2-yl)methylamin...
Create Date: 2005-08-01
CID: 453442

5893. CHEMBL98394; 135525-67-6; 3-((2-Benzimidazolylmethyl)amino)-5-ethyl-6-methlpyridin-2(1H)-one ...
MW:     282.340320 g/mol MF: C16H18N4O
IUPAC name: 3-(1H-benzimidazol-2-ylmethylamino)-5-ethyl-6-methyl-1H-pyri...
Create Date: 2005-08-01
CID: 453436

5894. 4'-Thio-2',3'-dideoxyguanosine; 137719-32-5; AC1L9Q7A ...
MW:     267.307520 g/mol MF: C10H13N5O2S
IUPAC name: 2-amino-9-[(2R,5S)-5-(hydroxymethyl)thiolan-2-yl]-3H-purin-6...
Create Date: 2005-08-01
CID: 452279

5895. SAA-12-VV-OMe; 126333-35-5; L-Valine, N-(N-((2-(hydroxy(2-phenyl-1-((N-(N-L-seryl-L-alanyl)-L-alanyl)amino)ethyl)phosphinyl)cyclopentyl)carbonyl)-L-valyl)-, methyl ester ...
MW:     738.808462 g/mol MF: C34H55N6O10P
IUPAC name: [(1R)-1-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-hydroxypropanoyl]...
Create Date: 2005-08-01
CID: 451642

5896. NSC329041; AC1L7AXG; NSC-329041 ...
MW:     431.465540 g/mol MF: C19H21N5O5S
Create Date: 2005-03-26
CID: 332344

5897. 83586-80-5; Azirino[2',4]pyrrolo[1,2-a]indole-4,7-dione, 8-[[(aminocarbonyl)oxy]methyl]-6-[(2,2-dimethoxyethyl)amino]-1,1a,2,8,8a,8b-hexahydro-8a-methoxy-5-methyl-, (1aR-(1a.alpha.,8.beta.,8a.alpha.,8b.alpha.))-; Azirino[2',4]pyrrolo[1,2-a]indole-4,7-dione, 8-[[(aminocarbonyl)oxy]methyl]-6-[(2,2-dimethoxyethyl)amino]-1,1a,2,8,8a,8b-hexahydro-8a-methoxy-5-methyl-, [1aR-(1a.alpha.,8.beta.,8a.alpha.,8b.alpha.)]- ...
MW:     422.432340 g/mol MF: C19H26N4O7
Create Date: 2005-03-26
CID: 332343

5898. Diacetoxyscirpenol; Anguidine; Anguidin ...
MW:     366.405540 g/mol MF: C19H26O7
Create Date: 2005-06-24
CID: 91518

5899. 5191-80-0; (R)-2-amino-3-(benzhydrylthio)propanoic acid; S-Diphenylmethyl-L-cysteine ...
MW:     287.376680 g/mol MF: C16H17NO2S
IUPAC name: (2R)-2-amino-3-benzhydrylsulfanylpropanoic acid
Create Date: 2005-08-08
CID: 21261

5900. Propyl Itraconazole; CHEMBL574469; Propyl itraconazole, (+/-)- ...
MW:     691.606840 g/mol MF: C34H36Cl2N8O4
IUPAC name: 4-[4-[4-[4-[[(2S,4R)-2-(2,4-dichlorophenyl)-2-(1,2,4-triazol...
Create Date: 2010-06-03
CID: 45481857

5901. CHEMBL460360; BDBM24953; 5-oxo dihydronaphthylcarbazole analogue, 20 ...
MW:     466.570800 g/mol MF: C30H30N2O3
Create Date: 2008-10-21
CID: 24971436

5902. CHEMBL517743; BDBM24952; 5-oxo dihydronaphthylcarbazole analogue, 19 ...
MW:     452.544220 g/mol MF: C29H28N2O3
Create Date: 2008-10-21
CID: 24971435

5903. CHEMBL459508; SCHEMBL3269160; BDBM24950 ...
MW:     384.427200 g/mol MF: C24H20N2O3
Create Date: 2008-10-21
CID: 24971434

5904. CHEMBL517117; BDBM24948; 5-oxo dihydronaphthylcarbazole analogue, 15 ...
MW:     412.480360 g/mol MF: C26H24N2O3
Create Date: 2008-10-21
CID: 24971433

5905. CHEMBL510795; BDBM24946; 5-oxo dihydronaphthylcarbazole analogue, 13 ...
MW:     368.427800 g/mol MF: C24H20N2O2
Create Date: 2008-10-21
CID: 24971432

5906. CHEMBL494302; SCHEMBL3264416; BDBM24945 ...
MW:     340.374640 g/mol MF: C22H16N2O2
Create Date: 2008-10-21
CID: 24971431

5907. CHEMBL467625; BDBM24956; 5-oxo dihydronaphthylcarbazole analogue, 23 ...
MW:     518.602300 g/mol MF: C33H30N2O4
Create Date: 2008-10-20
CID: 24967374

5908. CHEMBL461846; BDBM24951; 5-oxo dihydronaphthylcarbazole analogue, 18 ...
MW:     438.517640 g/mol MF: C28H26N2O3
Create Date: 2008-10-20
CID: 24965602

5909. CHEMBL459308; BDBM24957; 5-oxo dihydronaphthylcarbazole analogue, 24 ...
MW:     428.479760 g/mol MF: C26H24N2O4
Create Date: 2008-10-20
CID: 24965599

5910. CHEMBL518344; BDBM24958; 5-oxo dihydronaphthylcarbazole analogue, 25 ...
MW:     423.463240 g/mol MF: C26H21N3O3
Create Date: 2008-10-20
CID: 24964536

5911. CHEMBL460152; BDBM24959; 5-oxo dihydronaphthylcarbazole analogue, 26 ...
MW:     451.516400 g/mol MF: C28H25N3O3
Create Date: 2008-10-20
CID: 24964174

5912. CHEMBL459307; BDBM24955; 5-oxo dihydronaphthylcarbazole analogue, 22 ...
MW:     442.506340 g/mol MF: C27H26N2O4
Create Date: 2008-10-20
CID: 24964173

5913. CHEMBL460577; BDBM24954; 5-oxo dihydronaphthylcarbazole analogue, 21 ...
MW:     475.537800 g/mol MF: C30H25N3O3
Create Date: 2008-10-20
CID: 24964172

5914. CHEMBL410695; BDBM23830; ZINC5049518 ...
MW:     405.552380 g/mol MF: C25H27NO2S
IUPAC name: (2R)-2-amino-3-[tris(4-methylphenyl)methylsulfanyl]propanoic...
Create Date: 2008-07-30
CID: 24860499

5915. CHEMBL260522; BDBM23829; ZINC16954832 ...
MW:     423.524600 g/mol MF: C24H25NO4S
IUPAC name: (2R)-2-amino-3-[bis[4-(hydroxymethyl)phenyl]-phenylmethyl]su...
Create Date: 2008-07-30
CID: 24860498

5916. CHEMBL272406; BDBM23826; S-Trityl-L-Cysteine (STLC) Analogue, 55 ...
MW:     515.664560 g/mol MF: C34H29NO2S
IUPAC name: (2R)-2-amino-3-[phenyl-bis(4-phenylphenyl)methyl]sulfanylpro...
Create Date: 2008-07-30
CID: 24860497

5917. CHEMBL270344; BDBM23825; ZINC8627795 ...
MW:     379.472040 g/mol MF: C22H21NO3S
IUPAC name: (2R)-2-amino-3-[(4-hydroxyphenyl)-diphenylmethyl]sulfanylpro...
Create Date: 2008-07-30
CID: 24860496

5918. NSC-123139; CHEMBL429597; BDBM23822 ...
MW:     377.499220 g/mol MF: C23H23NO2S
IUPAC name: (2R)-2-amino-3-[(4-methylphenyl)-diphenylmethyl]sulfanylprop...
Create Date: 2008-07-30
CID: 24860495

5919. NSC-126217; CHEMBL412132; BDBM23821 ...
MW:     442.368700 g/mol MF: C22H20BrNO2S
IUPAC name: (2R)-2-amino-3-[(4-bromophenyl)-diphenylmethyl]sulfanylpropa...
Create Date: 2008-07-30
CID: 24860494

5920. CHEMBL412251; BDBM23819; ZINC5049520 ...
MW:     381.463103 g/mol MF: C22H20FNO2S
IUPAC name: (2R)-2-amino-3-[(4-fluorophenyl)-diphenylmethyl]sulfanylprop...
Create Date: 2008-07-30
CID: 24860493

5921. CHEMBL408325; BDBM23818; ZINC29135172 ...
MW:     708.930000 g/mol MF: C44H40N2O3S2
IUPAC name: (2R)-2-[[(2R)-2-amino-3-tritylsulfanylpropanoyl]amino]-3-tri...
Create Date: 2008-07-30
CID: 24860492

5922. CHEMBL410315; BDBM23816; S-Trityl-L-Cysteine (STLC) Analogue, 45 ...
MW:     434.550540 g/mol MF: C25H26N2O3S
IUPAC name: 2-[[(2R)-2-amino-3-tritylsulfanylpropanoyl]amino]propanoic a...
Create Date: 2008-07-30
CID: 24860491

5923. CHEMBL409317; BDBM23814; ZINC5084779 ...
MW:     476.630280 g/mol MF: C28H32N2O3S
IUPAC name: methyl (2S)-2-[[(2R)-2-amino-3-tritylsulfanylpropanoyl]amino...
Create Date: 2008-07-30
CID: 24860490

5924. CHEMBL436920; BDBM23813; ZINC16931423 ...
MW:     529.691140 g/mol MF: C35H31NO2S
IUPAC name: benzhydryl (2R)-2-amino-3-tritylsulfanylpropanoate
Create Date: 2008-07-30
CID: 24860489

5925. CHEMBL403650; SCHEMBL3756344; BDBM30415 ...
MW:     507.583100 g/mol MF: C21H25N5O6S2
IUPAC name: N-[(3E)-3-[1-(3,3-dimethylbutyl)-2,4-dioxopyrrolo[1,2-b]pyri...
Create Date: 2008-07-28
CID: 24860261

5926. CHEMBL257566; SCHEMBL3767178; BDBM30409 ...
MW:     430.477480 g/mol MF: C20H22N4O5S
IUPAC name: (3E)-3-(7-methoxy-1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-3...
Create Date: 2008-07-28
CID: 24860260

5927. CHEMBL253960; SCHEMBL3761100; BDBM30408 ...
MW:     400.451500 g/mol MF: C19H20N4O4S
IUPAC name: (3E)-3-(1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-3-ylidene)-...
Create Date: 2008-07-28
CID: 24860259

5928. CHEMBL253752; SCHEMBL3761984; BDBM30419 ...
MW:     565.981683 g/mol MF: C22H17ClFN5O6S2
IUPAC name: N-[(3E)-3-[1-[(3-chloro-4-fluorophenyl)methyl]-2,4-dioxopyrr...
Create Date: 2008-07-28
CID: 24858395

5929. CHEMBL258423; SCHEMBL3761357; BDBM30412 ...
MW:     518.565980 g/mol MF: C21H22N6O6S2
IUPAC name: N-[(3E)-3-[6-cyano-1-(3-methylbutyl)-2,4-dioxopyrrolo[1,2-b]...
Create Date: 2008-07-28
CID: 24858393

5930. CHEMBL403046; SCHEMBL3753946; BDBM30411 ...
MW:     511.546983 g/mol MF: C20H22FN5O6S2
IUPAC name: N-[(3E)-3-[6-fluoro-1-(3-methylbutyl)-2,4-dioxopyrrolo[1,2-b...
Create Date: 2008-07-28
CID: 24858230

5931. CHEMBL404096; SCHEMBL13059319; BDBM30414 ...
MW:     519.593800 g/mol MF: C22H25N5O6S2
IUPAC name: N-[(3E)-3-[1-(3-methylbutyl)-2,4-dioxopyrrolo[1,2-b]pyridazi...
Create Date: 2008-07-28
CID: 24858229

5932. CHEMBL404677; SCHEMBL3768343; BDBM30417 ...
MW:     438.431603 g/mol MF: C21H15FN4O4S
IUPAC name: (3E)-3-(1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-3-ylidene)-...
Create Date: 2008-07-28
CID: 24858228

5933. CHEMBL403067; SCHEMBL3762525; BDBM30421 ...
MW:     556.585843 g/mol MF: C25H21FN4O6S2
IUPAC name: (3E)-3-[7-(1,1-dioxothiolan-2-yl)-1,1-dioxo-4H-1$l^{6},2,4-b...
Create Date: 2008-07-28
CID: 24858227

5934. CHEMBL255107; SCHEMBL3759321; BDBM30420 ...
MW:     545.563203 g/mol MF: C23H20FN5O6S2
IUPAC name: N-[(3E)-3-[1-[(4-fluorophenyl)methyl]-2,4-dioxopyrrolo[1,2-b...
Create Date: 2008-07-28
CID: 24858226

5935. BMCL19451 Compound 2; BMCL185002 Compound 3a; CHEMBL404663 ...
MW:     531.536623 g/mol MF: C22H18FN5O6S2
IUPAC name: N-[(3E)-3-[1-[(4-fluorophenyl)methyl]-2,4-dioxopyrrolo[1,2-b...
Create Date: 2008-07-28
CID: 24858075

5936. CHEMBL254968; SCHEMBL3762439; BDBM30413 ...
MW:     507.583100 g/mol MF: C21H25N5O6S2
IUPAC name: N-methyl-N-[(3E)-3-[1-(3-methylbutyl)-2,4-dioxopyrrolo[1,2-b...
Create Date: 2008-07-28
CID: 24858072

5937. CHEMBL429676; SCHEMBL3766538; BDBM30416 ...
MW:     521.609680 g/mol MF: C22H27N5O6S2
IUPAC name: N-[(3E)-3-[1-(3,3-dimethylbutyl)-2,4-dioxopyrrolo[1,2-b]pyri...
Create Date: 2008-07-28
CID: 24858071

5938. CHEMBL200894; BDBM16124; Biphenyl-4-ylcarbamoyl Thiophene Analog 15 ...
MW:     415.391663 g/mol MF: C20H14FNO6S
IUPAC name: 4-[[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl]thiophene-2...
Create Date: 2008-01-19
CID: 23647307

5939. CHEMBL426299; BDBM16123; Biphenyl-4-ylcarbamoyl Thiophene Analog 14 ...
MW:     415.391663 g/mol MF: C20H14FNO6S
IUPAC name: 3-[[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl]thiophene-2...
Create Date: 2008-01-19
CID: 23647306

5940. CHEMBL371482; BDBM16122; Biphenyl-4-ylcarbamoyl Thiophene Analog 13 ...
MW:     415.391663 g/mol MF: C20H14FNO6S
IUPAC name: 3-[[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl]thiophene-2...
Create Date: 2008-01-19
CID: 23647305

5941. SCHEMBL518904; BDBM16121; Biphenyl-4-ylcarbamoyl Thiophene Analog 12 ...
MW:     443.344016 g/mol MF: C19H10F5NO4S
IUPAC name: 4-[[2,6-difluoro-4-[3-(trifluoromethoxy)phenyl]phenyl]carbam...
Create Date: 2008-01-19
CID: 23647304

5942. CHEMBL383165; SCHEMBL1124252; BDBM16120 ...
MW:     403.399206 g/mol MF: C20H15F2NO4S
IUPAC name: 4-[[4-(2-ethoxyphenyl)-2,6-difluorophenyl]carbamoyl]thiophen...
Create Date: 2008-01-19
CID: 23647303

5943. CHEMBL199501; SCHEMBL1124246; BDBM16119 ...
MW:     323.365720 g/mol MF: C18H13NO3S
IUPAC name: 4-[(4-phenylphenyl)carbamoyl]thiophene-3-carboxylic acid
Create Date: 2008-01-19
CID: 23647302

5944. CHEMBL193368; BDBM13922; pyrrolo[2,1-f][1,2,4]triazine analog 8a ...
MW:     520.585020 g/mol MF: C29H28N8O2
IUPAC name: 3-imidazol-1-ylpropyl 4-[(1-benzylindazol-5-yl)amino]-5-ethy...
Create Date: 2008-01-19
CID: 23646550

5945. CHEMBL372523; SCHEMBL1728685; BDBM13915 ...
MW:     517.581080 g/mol MF: C30H27N7O2
IUPAC name: benzyl N-[4-[(1-benzylindazol-5-yl)amino]-5-ethylpyrrolo[2,1...
Create Date: 2008-01-19
CID: 23646546

5946. CHEMBL197689; BDBM13913; pyrrolo[2,1-f][1,2,4]triazine analog 7b ...
MW:     425.485720 g/mol MF: C24H23N7O
IUPAC name: 4-[(1-benzylindazol-5-yl)amino]-5-ethyl-N-methylpyrrolo[2,1-...
Create Date: 2008-01-19
CID: 23646545

5947. CHEMBL194958; BDBM13912; pyrrolo[2,1-f][1,2,4]triazine analog 7a ...
MW:     411.459140 g/mol MF: C23H21N7O
IUPAC name: 4-[(1-benzylindazol-5-yl)amino]-5-ethylpyrrolo[2,1-f][1,2,4]...
Create Date: 2008-01-19
CID: 23646544

5948. CHEMBL197568; SCHEMBL4049084; BDBM13910 ...
MW:     502.566440 g/mol MF: C30H26N6O2
IUPAC name: ethyl 5-benzyl-4-[(1-benzylindazol-5-yl)amino]pyrrolo[2,1-f]...
Create Date: 2008-01-19
CID: 23646543

5949. CHEMBL365606; SCHEMBL4051262; BDBM13908 ...
MW:     454.523640 g/mol MF: C26H26N6O2
IUPAC name: ethyl 4-[(1-benzylindazol-5-yl)amino]-5-propan-2-ylpyrrolo[2...
Create Date: 2008-01-19
CID: 23646542

5950. CHEMBL196738; BDBM13907; pyrrolo[2,1-f][1,2,4]triazine analog 5h ...
MW:     426.470480 g/mol MF: C24H22N6O2
IUPAC name: ethyl 4-[(1-benzylindazol-5-yl)amino]-5-methylpyrrolo[2,1-f]...
Create Date: 2008-01-19
CID: 23646541

5951. CHEMBL425738; BDBM13906; pyrrolo[2,1-f][1,2,4]triazine analog 5g ...
MW:     412.443900 g/mol MF: C23H20N6O2
IUPAC name: ethyl 4-[(1-benzylindazol-5-yl)amino]pyrrolo[2,1-f][1,2,4]tr...
Create Date: 2008-01-19
CID: 23646540

5952. CHEMBL194349; SCHEMBL4046743; BDBM13905 ...
MW:     402.445780 g/mol MF: C23H22N4O3
IUPAC name: ethyl 5-ethyl-4-(4-phenoxyanilino)pyrrolo[2,1-f][1,2,4]triaz...
Create Date: 2008-01-19
CID: 23646539

5953. SCHEMBL4045650; BDBM13903; pyrrolo[2,1-f][1,2,4]triazine analog 5d ...
MW:     338.403580 g/mol MF: C19H22N4O2
IUPAC name: ethyl 5-ethyl-4-[[(1R)-1-phenylethyl]amino]pyrrolo[2,1-f][1,...
Create Date: 2008-01-19
CID: 23646538

5954. CHEMBL372112; BDBM13902; pyrrolo[2,1-f][1,2,4]triazine analog 5c ...
MW:     350.374520 g/mol MF: C18H18N6O2
IUPAC name: ethyl 5-ethyl-4-(1H-indazol-5-ylamino)pyrrolo[2,1-f][1,2,4]t...
Create Date: 2008-01-19
CID: 23646537

5955. CHEMBL370934; SCHEMBL4042632; BDBM13901 ...
MW:     389.246480 g/mol MF: C17H17BrN4O2
IUPAC name: ethyl 4-(3-bromoanilino)-5-ethylpyrrolo[2,1-f][1,2,4]triazin...
Create Date: 2008-01-19
CID: 23646536

5956. CHEMBL196018; SCHEMBL4052320; BDBM13900 ...
MW:     362.785943 g/mol MF: C17H16ClFN4O2
IUPAC name: ethyl 4-(3-chloro-4-fluoroanilino)-5-ethylpyrrolo[2,1-f][1,2...
Create Date: 2008-01-19
CID: 23646535

5957. 3co9; SCHEMBL3763178; BDBM30410 ...
MW:     493.556520 g/mol MF: C20H23N5O6S2
IUPAC name: N-[(3E)-3-[1-(3-methylbutyl)-2,4-dioxopyrrolo[1,2-b]pyridazi...
Create Date: 2008-01-07
CID: 23635934

5958. CHEMBL438805; SCHEMBL4051504; BDBM13909 ...
MW:     454.523640 g/mol MF: C26H26N6O2
IUPAC name: ethyl 4-[(1-benzylindazol-5-yl)amino]-5-propylpyrrolo[2,1-f]...
Create Date: 2007-12-12
CID: 23589555

5959. CHEMBL196925; SCHEMBL1462065; BDBM13904 ...
MW:     440.497060 g/mol MF: C25H24N6O2
IUPAC name: ethyl 4-[(1-benzylindazol-5-yl)amino]-5-ethylpyrrolo[2,1-f][...
Create Date: 2007-12-12
CID: 23589545

5960. CEP-5104; CHEMBL460989; SCHEMBL3264941 ...
MW:     398.453780 g/mol MF: C25H22N2O3
Create Date: 2007-12-06
CID: 23378546

5961. CHEMBL193681; SCHEMBL5514457; BDBM13921 ...
MW:     519.600260 g/mol MF: C29H29N9O
IUPAC name: 4-[(1-benzylindazol-5-yl)amino]-5-ethyl-N-(3-imidazol-1-ylpr...
Create Date: 2007-12-05
CID: 21945968

5962. CHEMBL372293; SCHEMBL1460836; BDBM13914 ...
MW:     439.512300 g/mol MF: C25H25N7O
IUPAC name: 4-[(1-benzylindazol-5-yl)amino]-5-ethyl-N,N-dimethylpyrrolo[...
Create Date: 2007-12-05
CID: 21945841

5963. CHEMBL411702; SCHEMBL14537506; BDBM23824 ...
MW:     393.498620 g/mol MF: C23H23NO3S
IUPAC name: (2R)-2-amino-3-[[4-(hydroxymethyl)phenyl]-diphenylmethyl]sul...
Create Date: 2007-12-05
CID: 21144473

5964. L-Cysteine, S-[bis(4-methoxyphenyl)phenylmethyl]-; CHEMBL272404; BDBM23827 ...
MW:     423.524600 g/mol MF: C24H25NO4S
IUPAC name: (2R)-2-amino-3-[bis(4-methoxyphenyl)-phenylmethyl]sulfanylpr...
Create Date: 2007-12-05
CID: 21144451

5965. CHEMBL409295; BDBM23828; ZINC8637979 ...
MW:     391.525800 g/mol MF: C24H25NO2S
IUPAC name: (2R)-2-amino-3-[bis(4-methylphenyl)-phenylmethyl]sulfanylpro...
Create Date: 2007-12-05
CID: 21140146

5966. NSC-123138; CHEMBL409102; BDBM23820 ...
MW:     397.917700 g/mol MF: C22H20ClNO2S
IUPAC name: (2R)-2-amino-3-[(4-chlorophenyl)-diphenylmethyl]sulfanylprop...
Create Date: 2007-12-05
CID: 21140145

5967. 26988-61-4; CHEMBL270748; BDBM23815 ...
MW:     420.523960 g/mol MF: C24H24N2O3S
IUPAC name: 2-[[(2R)-2-amino-3-tritylsulfanylpropanoyl]amino]acetic acid
Create Date: 2007-12-05
CID: 21117270

5968. CHEMBL226779; SCHEMBL14236498; BDBM29588 ...
MW:     524.590260 g/mol MF: C29H24N4O4S
IUPAC name: 2-[1-benzyl-2-oxo-5-[(2S)-2-(phenoxymethyl)pyrrolidin-1-yl]s...
Create Date: 2007-10-15
CID: 16749269

5969. CHEMBL196438; SCHEMBL1730679; BDBM13911 ...
MW:     412.443900 g/mol MF: C23H20N6O2
IUPAC name: 4-[(1-benzylindazol-5-yl)amino]-5-ethylpyrrolo[2,1-f][1,2,4]...
Create Date: 2007-09-17
CID: 16730263

5970. BDBM9229; CHEMBL278928; 1,2,5-thiadiazolidine 1,1-dioxide analog ...
MW:     639.803540 g/mol MF: C37H41N3O5S
IUPAC name: (2R,4S)-2-benzyl-5-[(3S)-3,5-dibenzyl-1,1-dioxo-1,2,5-thiadi...
Create Date: 2007-03-08
CID: 15954111

5971. CHEMBL398146; 27686-50-6; AmbotzTAA1508 ...
MW:     605.787100 g/mol MF: C41H35NO2S
IUPAC name: (2R)-2-(tritylamino)-3-tritylsulfanylpropanoic acid
Create Date: 2007-02-09
CID: 14081820

5972. CHEMBL1179401; BDBM14721; pyridinium-containing sulfonamide analog 14d
MW:     524.699700 g/mol MF: C22H30N5O4S3+
IUPAC name: 5-[[4-(2,6-ditert-butyl-4-methylpyridin-1-ium-1-yl)phenyl]su...
Create Date: 2006-10-26
CID: 11763513

5973. CHEMBL1179459; BDBM14736; pyridinium-containing sulfonamide analog 14t
MW:     454.566800 g/mol MF: C17H20N5O4S3+
IUPAC name: 5-[[4-(2,3,4,6-tetramethylpyridin-1-ium-1-yl)phenyl]sulfonyl...
Create Date: 2006-10-26
CID: 11744654

5974. CHEMBL1179478; BDBM14731; pyridinium-containing sulfonamide analog 14o
MW:     606.758720 g/mol MF: C29H28N5O4S3+
IUPAC name: 5-[[4-(2-butyl-4,6-diphenylpyridin-1-ium-1-yl)phenyl]sulfony...
Create Date: 2006-10-26
CID: 11479560

5975. CHEMBL1183619; BDBM14733; pyridinium-containing sulfonamide analog 14q
MW:     564.678980 g/mol MF: C26H22N5O4S3+
IUPAC name: 5-[[4-(4-methyl-2,6-diphenylpyridin-1-ium-1-yl)phenyl]sulfon...
Create Date: 2006-10-26
CID: 11479386

5976. CHEMBL1183648; BDBM14726; pyridinium-containing sulfonamide analog 14i
MW:     558.715920 g/mol MF: C25H28N5O4S3+
IUPAC name: 5-[[4-[4-phenyl-2,6-di(propan-2-yl)pyridin-1-ium-1-yl]phenyl...
Create Date: 2006-10-26
CID: 11467963

5977. CHEMBL1179456; BDBM14724; ZINC14956367 ...
MW:     558.715920 g/mol MF: C25H28N5O4S3+
IUPAC name: 5-[[4-(4-phenyl-2,6-dipropylpyridin-1-ium-1-yl)phenyl]sulfon...
Create Date: 2006-10-26
CID: 11433768

5978. CHEMBL1179450; BDBM14723; pyridinium-containing sulfonamide analog 14f
MW:     530.662760 g/mol MF: C23H24N5O4S3+
IUPAC name: 5-[[4-(2,6-diethyl-4-phenylpyridin-1-ium-1-yl)phenyl]sulfony...
Create Date: 2006-10-26
CID: 11433609

5979. CHEMBL1183607; BDBM14728; pyridinium-containing sulfonamide analog 14k
MW:     578.705560 g/mol MF: C27H24N5O4S3+
IUPAC name: 5-[[4-(2-ethyl-4,6-diphenylpyridin-1-ium-1-yl)phenyl]sulfony...
Create Date: 2006-10-26
CID: 11399716

5980. CHEMBL1179484; BDBM14737; pyridinium-containing sulfonamide analog 14u
MW:     516.636180 g/mol MF: C22H22N5O4S3+
IUPAC name: 5-[[4-(2,3,6-trimethyl-4-phenylpyridin-1-ium-1-yl)phenyl]sul...
Create Date: 2006-10-26
CID: 11399351

5981. CHEMBL1183603; BDBM14720; pyridinium-containing sulfonamide analog 14c
MW:     496.646540 g/mol MF: C20H26N5O4S3+
IUPAC name: 5-[[4-[4-methyl-2,6-di(propan-2-yl)pyridin-1-ium-1-yl]phenyl...
Create Date: 2006-10-26
CID: 11387800

5982. CHEMBL1183641; BDBM14729; pyridinium-containing sulfonamide analog 14m
MW:     592.732140 g/mol MF: C28H26N5O4S3+
IUPAC name: 5-[[4-(2,4-diphenyl-6-propylpyridin-1-ium-1-yl)phenyl]sulfon...
Create Date: 2006-10-26
CID: 11342942

5983. CHEMBL1179486; BDBM14732; pyridinium-containing sulfonamide analog 14p
MW:     606.758720 g/mol MF: C29H28N5O4S3+
IUPAC name: 5-[[4-(2-tert-butyl-4,6-diphenylpyridin-1-ium-1-yl)phenyl]su...
Create Date: 2006-10-26
CID: 11274030

5984. CHEMBL1183658; BDBM14725; pyridinium-containing sulfonamide analog 14h
MW:     586.769080 g/mol MF: C27H32N5O4S3+
IUPAC name: 5-[[4-(2,6-dibutyl-4-phenylpyridin-1-ium-1-yl)phenyl]sulfony...
Create Date: 2006-10-26
CID: 11262485

5985. CHEMBL1179444; BDBM14719; pyridinium-containing sulfonamide analog 14b
MW:     468.593380 g/mol MF: C18H22N5O4S3+
IUPAC name: 5-[[4-(2,4-dimethyl-6-propan-2-ylpyridin-1-ium-1-yl)phenyl]s...
Create Date: 2006-10-26
CID: 11261583

5986. CHEMBL1185325; BDBM14735; pyridinium-containing sulfonamide analog 14s
MW:     550.652400 g/mol MF: C25H20N5O4S3+
IUPAC name: 5-[[4-(2,6-diphenylpyridin-1-ium-1-yl)phenyl]sulfonylamino]-...
Create Date: 2006-10-26
CID: 11250792

5987. CHEMBL1182737; BDBM14730; pyridinium-containing sulfonamide analog 14n
MW:     592.732140 g/mol MF: C28H26N5O4S3+
IUPAC name: 5-[[4-(2,4-diphenyl-6-propan-2-ylpyridin-1-ium-1-yl)phenyl]s...
Create Date: 2006-10-26
CID: 11239394

5988. 21947-98-8; N-Boc-S-Trityl-L-cysteine; Boc-S-trityl-L-cysteine ...
MW:     463.588460 g/mol MF: C27H29NO4S
IUPAC name: (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-tritylsulfa...
Create Date: 2006-10-26
CID: 11167161

5989. CHEMBL1183608; BDBM14727; pyridinium-containing sulfonamide analog 14j
MW:     564.678980 g/mol MF: C26H22N5O4S3+
IUPAC name: 5-[[4-(2-methyl-4,6-diphenylpyridin-1-ium-1-yl)phenyl]sulfon...
Create Date: 2006-10-26
CID: 11158129

5990. CHEMBL1183654; BDBM14734; pyridinium-containing sulfonamide analog 14r ...
MW:     626.748360 g/mol MF: C31H24N5O4S3+
IUPAC name: 5-[[4-(2,4,6-triphenylpyridin-1-ium-1-yl)phenyl]sulfonylamin...
Create Date: 2006-10-25
CID: 10509025

5991. CHEMBL345701; SCHEMBL252035; BDBM16112 ...
MW:     409.331013 g/mol MF: C20H15F4NO4
IUPAC name: 2-[[2,3,5,6-tetrafluoro-4-(2-methoxyphenyl)phenyl]carbamoyl]...
Create Date: 2006-10-25
CID: 10454174

5992. CHEMBL1179476; BDBM14722; pyridinium-containing sulfonamide analog 14e
MW:     502.609600 g/mol MF: C21H20N5O4S3+
IUPAC name: 5-[[4-(2,6-dimethyl-4-phenylpyridin-1-ium-1-yl)phenyl]sulfon...
Create Date: 2006-10-25
CID: 10436089

5993. CHEMBL232728; methyl (2R)-2-amino-3-[(triphenylmethyl)sulfanyl]propanoate; Methyl S-trityl-L-cysteinate ...
MW:     377.499220 g/mol MF: C23H23NO2S
IUPAC name: methyl (2R)-2-amino-3-tritylsulfanylpropanoate
Create Date: 2006-10-25
CID: 10429690

5994. CHEMBL1182755; BDBM14718; pyridinium-containing sulfonamide analog 14a ...
MW:     440.540220 g/mol MF: C16H18N5O4S3+
IUPAC name: 5-[[4-(2,4,6-trimethylpyridin-1-ium-1-yl)phenyl]sulfonylamin...
Create Date: 2006-10-25
CID: 10343149

5995. CHEMBL423323; SCHEMBL2979275; BDBM50147468 ...
MW:     455.486940 g/mol MF: C21H21N5O5S
IUPAC name: 3-[4-(2-methoxyphenyl)-2,5-dioxopyrrol-3-yl]-1-[3-(sulfamoyl...
Create Date: 2006-10-25
CID: 10072710

5996. CHEMBL348270; SCHEMBL249112; BDBM16109 ...
MW:     307.343180 g/mol MF: C19H17NO3
IUPAC name: 2-[(4-phenylphenyl)carbamoyl]cyclopentene-1-carboxylic acid
Create Date: 2006-10-25
CID: 9948506

5997. CHEMBL412367; SCHEMBL1728562; BDBM13923 ...
MW:     521.573080 g/mol MF: C28H27N9O2
IUPAC name: 2-imidazol-1-ylethyl N-[4-[(1-benzylindazol-5-yl)amino]-5-et...
Create Date: 2006-10-25
CID: 9871380

5998. CEP-6331; CHEMBL460990; BDBM24949 ...
MW:     426.506940 g/mol MF: C27H26N2O3
Create Date: 2006-10-25
CID: 9823787

5999. Vidofludimus; 717824-30-1; UNII-8Y1PJ3VG81 ...
MW:     355.359623 g/mol MF: C20H18FNO4
IUPAC name: 2-[[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl]cyclopenten...
Create Date: 2006-10-25
CID: 9820008

6000. H-CYS(MMT)-OH; CHEMBL392369; AC1OMOAX ...
MW:     393.498620 g/mol MF: C23H23NO3S
IUPAC name: (2R)-2-amino-3-[(4-methoxyphenyl)-diphenylmethyl]sulfanylpro...
Create Date: 2006-07-29
CID: 7472794

6001. 27486-87-9; N-acetyl-S-trityl-L-cysteine; CHEMBL415259 ...
MW:     405.509320 g/mol MF: C24H23NO3S
IUPAC name: (2R)-2-acetamido-3-tritylsulfanylpropanoic acid
Create Date: 2006-07-29
CID: 7408363

6002. 247091-20-9; L-Alanine, N-((((2Z)-2-((2-amino-6-methoxy-9H-purin-9-yl)methylene)cyclopropyl)methoxy)phenoxyphosphinyl)-, methyl ester; L-Alanine, N-[[[(2Z)-2-[(2-amino-6-methoxy-9H-purin-9-yl)methylene]cyclopropyl]methoxy]phenoxyphosphinyl]-, methyl ester ...
MW:     488.433562 g/mol MF: C21H25N6O6P
IUPAC name: methyl (2S)-2-[[[(1S,2Z)-2-[(2-amino-6-methoxypurin-9-yl)met...
Create Date: 2005-08-01
CID: 3003139

6003. CHEMBL2115250; AC1LA6S4; SCHEMBL7293574 ...
MW:     594.741540 g/mol MF: C33H46N4O6
IUPAC name: benzyl N-[(2S)-4-amino-1-[[(2S,3R)-4-[(1R,2R)-2-(tert-butylc...
Create Date: 2005-08-01
CID: 462758

6004. AC1L9MX2; CHEMBL410131; BDBM23807 ...
MW:     457.607020 g/mol MF: C27H23NO2S2
IUPAC name: 2-(thiophen-2-ylmethylideneamino)-3-tritylsulfanylpropanoic ...
Create Date: 2005-03-26
CID: 422868

6005. NSC129931; AC1L5Q7B; CHEMBL260301 ...
MW:     529.691140 g/mol MF: C35H31NO2S
IUPAC name: 2-(benzhydrylamino)-3-tritylsulfanylpropanoic acid
Create Date: 2005-03-26
CID: 279428

6006. AC1L4Z72; CHEMBL1196870; BDBM23817 ...
MW:     490.656860 g/mol MF: C29H34N2O3S
IUPAC name: methyl (2S)-2-[[(2R)-2-amino-3-tritylsulfanylpropanoyl]amino...
Create Date: 2005-08-09
CID: 215629

6007. NSC 134250; L-3-((alpha,alpha-Diphenylpiperonyl)thio)alanine; ALANINE, 3-((alpha,alpha-DIPHENYLPIPERONYL)THIO)-, L- ...
MW:     407.482140 g/mol MF: C23H21NO4S
IUPAC name: (2R)-2-amino-3-[1,3-benzodioxol-5-yl(diphenyl)methyl]sulfany...
Create Date: 2005-08-08
CID: 37323

6008. S(-)-IHMB; S(-)-SCH-23388, Iodo analog hydrochloride
MW:     415.696330 g/mol MF: C17H19ClINO
IUPAC name: (5S)-8-iodo-3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepi...
Create Date: 2013-05-17
CID: 71312464

6009. Isopropyl Itraconazole; CHEMBL1835959; Isopropyl itraconazole, (+/-)- ...
MW:     691.606840 g/mol MF: C34H36Cl2N8O4
IUPAC name: 4-[4-[4-[4-[[(2S,4R)-2-(2,4-dichlorophenyl)-2-(1,2,4-triazol...
Create Date: 2012-02-06
CID: 56593985

6010. UDP group; BDBM50096295; Uridine dinucleoside 5''-polyphosphate analogue ...
MW:     402.145304 g/mol MF: C9H12N2O12P2-2
IUPAC name: [[5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]metho...
Create Date: 2009-11-19
CID: 44287897

6011. CHEMBL478694; BDBM29587; isatin Michael acceptor (IMA) analogue, 19c
MW:     487.358440 g/mol MF: C22H16Cl2N4O3S
IUPAC name: 2-[1-[(3,4-dichlorophenyl)methyl]-2-oxo-5-pyrrolidin-1-ylsul...
Create Date: 2009-06-25
CID: 42618293

6012. CHEMBL477659; BDBM29586; isatin Michael acceptor (IMA) analogue, 19b
MW:     448.494300 g/mol MF: C23H20N4O4S
IUPAC name: 2-[1-[(4-methoxyphenyl)methyl]-2-oxo-5-pyrrolidin-1-ylsulfon...
Create Date: 2009-06-25
CID: 42618292

6013. CHEMBL477047; BDBM29585; isatin Michael acceptor (IMA) analogue, 19a
MW:     418.468320 g/mol MF: C22H18N4O3S
IUPAC name: 2-(1-benzyl-2-oxo-5-pyrrolidin-1-ylsulfonylindol-3-ylidene)p...
Create Date: 2009-06-25
CID: 42618291

6014. CHEMBL510809; BDBM29584; isatin Michael acceptor (IMA) analogue, 18c
MW:     473.331860 g/mol MF: C21H14Cl2N4O3S
IUPAC name: 2-[5-(azetidin-1-ylsulfonyl)-1-[(3,4-dichlorophenyl)methyl]-...
Create Date: 2009-06-25
CID: 42618290

6015. CHEMBL476023; BDBM29583; isatin Michael acceptor (IMA) analogue, 18b
MW:     434.467720 g/mol MF: C22H18N4O4S
IUPAC name: 2-[5-(azetidin-1-ylsulfonyl)-1-[(4-methoxyphenyl)methyl]-2-o...
Create Date: 2009-06-25
CID: 42618289

6016. CHEMBL516251; BDBM29582; isatin Michael acceptor (IMA) analogue, 18a
MW:     404.441740 g/mol MF: C21H16N4O3S
IUPAC name: 2-[5-(azetidin-1-ylsulfonyl)-1-benzyl-2-oxoindol-3-ylidene]p...
Create Date: 2009-06-25
CID: 42618288

6017. 2-[1-(3,4-Dichlorobenzyl)-2-oxo-5-(thiomorpholinosulfonyl)indolin-3-ylidene]malononitrile; 1144853-65-5; CHEMBL490851 ...
MW:     519.423440 g/mol MF: C22H16Cl2N4O3S2
IUPAC name: 2-[1-[(3,4-dichlorophenyl)methyl]-2-oxo-5-thiomorpholin-4-yl...
Create Date: 2009-06-25
CID: 42618286

6018. 2-[(4-METHOXYBENZYL)-2-OXO-5-(THIOMORPHOLINOSULFONYL)INDOLIN-3-YLIDENE]MALONONITRILE; 1144853-59-7; CHEMBL490850 ...
MW:     480.559300 g/mol MF: C23H20N4O4S2
IUPAC name: 2-[1-[(4-methoxyphenyl)methyl]-2-oxo-5-thiomorpholin-4-ylsul...
Create Date: 2009-06-25
CID: 42618285

6019. 2-[(1-Benzyl-2-oxo-5-(thiomorpholinosulfonyl)indolin-3-ylidene]malononitrile; 1144853-53-1; CHEMBL523131 ...
MW:     450.533320 g/mol MF: C22H18N4O3S2
IUPAC name: 2-(1-benzyl-2-oxo-5-thiomorpholin-4-ylsulfonylindol-3-yliden...
Create Date: 2009-06-25
CID: 42618284

6020. CHEMBL521972; BDBM29577; isatin Michael acceptor (IMA) analogue, 12c
MW:     503.357840 g/mol MF: C22H16Cl2N4O4S
IUPAC name: 2-[1-[(3,4-dichlorophenyl)methyl]-5-morpholin-4-ylsulfonyl-2...
Create Date: 2009-06-25
CID: 42618283

6021. CHEMBL492061; BDBM29576; isatin Michael acceptor (IMA) analogue, 12b
MW:     464.493700 g/mol MF: C23H20N4O5S
IUPAC name: 2-[1-[(4-methoxyphenyl)methyl]-5-morpholin-4-ylsulfonyl-2-ox...
Create Date: 2009-06-25
CID: 42618282

6022. CHEMBL492060; BDBM29575; isatin Michael acceptor (IMA) analogue, 12a
MW:     434.467720 g/mol MF: C22H18N4O4S
IUPAC name: 2-(1-benzyl-5-morpholin-4-ylsulfonyl-2-oxoindol-3-ylidene)pr...
Create Date: 2009-06-25
CID: 42618281

6023. CHEMBL492059; BDBM29574; isatin Michael acceptor (IMA) analogue, 11c
MW:     501.385020 g/mol MF: C23H18Cl2N4O3S
IUPAC name: 2-[1-[(3,4-dichlorophenyl)methyl]-2-oxo-5-piperidin-1-ylsulf...
Create Date: 2009-06-25
CID: 42618280

6024. CHEMBL521801; BDBM29573; isatin Michael acceptor (IMA) analogue, 11b
MW:     462.520880 g/mol MF: C24H22N4O4S
IUPAC name: 2-[1-[(4-methoxyphenyl)methyl]-2-oxo-5-piperidin-1-ylsulfony...
Create Date: 2009-06-25
CID: 42618279

6025. CHEMBL519148; BDBM29572; isatin Michael acceptor (IMA) analogue, 11a
MW:     432.494900 g/mol MF: C23H20N4O3S
IUPAC name: 2-(1-benzyl-2-oxo-5-piperidin-1-ylsulfonylindol-3-ylidene)pr...
Create Date: 2009-06-25
CID: 42618278

6026. CHEMBL1186431; BDBM26977; 2-benzoylquinazoline analogue, (1S, 2R)-17 ...
MW:     451.951840 g/mol MF: C23H26ClN7O
IUPAC name: 4-chloro-N-[4-[[(1R,2S)-2-(diaminomethylideneamino)cyclohexy...
Create Date: 2009-03-16
CID: 25190637

6027. CHEMBL562099; SCHEMBL3289005; BDBM26976 ...
MW:     451.951840 g/mol MF: C23H26ClN7O
IUPAC name: 4-chloro-N-[4-[[(1S,2R)-2-(diaminomethylideneamino)cyclohexy...
Create Date: 2009-03-16
CID: 25190636

6028. BDBM20647; pyrrolo[2,1-f][1,2,4]triazine analogue, 3i; ethyl 4-{[5-(methoxycarbamoyl)-2-methylphenyl]amino}-5-(propan-2-yl)pyrrolo[1,2-a][1,2,4]triazine-6-carboxylate
MW:     411.454300 g/mol MF: C21H25N5O4
IUPAC name: ethyl 4-[5-(methoxycarbamoyl)-2-methylanilino]-5-propan-2-yl...
Create Date: 2008-03-24
CID: 24755249

6029. BDBM20646; pyrrolo[2,1-f][1,2,4]triazine analogue, 3h; ethyl 5-ethyl-4-{[5-(methoxycarbamoyl)-2-methylphenyl]amino}pyrrolo[1,2-a][1,2,4]triazine-6-carboxylate
MW:     397.427720 g/mol MF: C20H23N5O4
IUPAC name: ethyl 5-ethyl-4-[5-(methoxycarbamoyl)-2-methylanilino]pyrrol...
Create Date: 2008-03-24
CID: 24755248

6030. CHEMBL400996; BDBM20644; pyrrolo[2,1-f][1,2,4]triazine analogue, 3f ...
MW:     355.347980 g/mol MF: C17H17N5O4
IUPAC name: methyl 4-[5-(methoxycarbamoyl)-2-methylanilino]pyrrolo[2,1-f...
Create Date: 2008-03-24
CID: 24755247

6031. CHEMBL251928; BDBM20643; pyrrolo[2,1-f][1,2,4]triazine analogue, 3e ...
MW:     383.401140 g/mol MF: C19H21N5O4
IUPAC name: methyl 4-[5-(ethoxycarbamoyl)-2-methylanilino]-5-methylpyrro...
Create Date: 2008-03-24
CID: 24755189

6032. CHEMBL399575; SCHEMBL4108826; BDBM20642 ...
MW:     367.401740 g/mol MF: C19H21N5O3
IUPAC name: methyl 4-[5-(ethylcarbamoyl)-2-methylanilino]-5-methylpyrrol...
Create Date: 2008-03-24
CID: 24755188

6033. CHEMBL255042; BDBM20641; pyrrolo[2,1-f][1,2,4]triazine analogue, 3c ...
MW:     339.348580 g/mol MF: C17H17N5O3
IUPAC name: methyl 4-(5-carbamoyl-2-methylanilino)-5-methylpyrrolo[2,1-f...
Create Date: 2008-03-24
CID: 24755187

6034. CHEMBL252127; BDBM20640; pyrrolo[2,1-f][1,2,4]triazine analogue, 3b ...
MW:     369.374560 g/mol MF: C18H19N5O4
IUPAC name: methyl 4-[5-(methoxycarbamoyl)-2-methylanilino]-5-methylpyrr...
Create Date: 2008-03-24
CID: 24755186

6035. CHEMBL252126; BDBM20639; pyrrolo[2,1-f][1,2,4]triazine analogue, 3a ...
MW:     353.375160 g/mol MF: C18H19N5O3
IUPAC name: methyl 5-methyl-4-[2-methyl-5-(methylcarbamoyl)anilino]pyrro...
Create Date: 2008-03-24
CID: 24755185

6036. CHEMBL241348; BDBM23025; N-arachidonoylserotonin carbamate analogue, 3p ...
MW:     326.346520 g/mol MF: C18H18N2O4
IUPAC name: (4-methoxyphenyl) N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]carbam...
Create Date: 2008-03-17
CID: 24749698

6037. CHEMBL394120; BDBM23023; N-arachidonoylserotonin carbamate analogue, 3n ...
MW:     422.217070 g/mol MF: C17H15IN2O3
IUPAC name: (4-iodophenyl) N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]carbamate
Create Date: 2008-03-17
CID: 24749592

6038. CHEMBL241137; BDBM23021; N-arachidonoylserotonin carbamate analogue, 3l ...
MW:     330.765600 g/mol MF: C17H15ClN2O3
IUPAC name: (4-chlorophenyl) N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]carbama...
Create Date: 2008-03-17
CID: 24749591

6039. CHEMBL396861; BDBM23020; N-arachidonoylserotonin carbamate analogue, 3k ...
MW:     330.765600 g/mol MF: C17H15ClN2O3
IUPAC name: (3-chlorophenyl) N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]carbama...
Create Date: 2008-03-17
CID: 24749590

6040. CHEMBL240274; BDBM23018; N-arachidonoylserotonin carbamate analogue, 3i ...
MW:     364.318510 g/mol MF: C18H15F3N2O3
IUPAC name: [3-(trifluoromethyl)phenyl] N-[2-(5-hydroxy-1H-indol-3-yl)et...
Create Date: 2008-03-17
CID: 24749589

6041. CHEMBL396860; BDBM23016; N-arachidonoylserotonin carbamate analogue, 3g
MW:     352.426860 g/mol MF: C21H24N2O3
IUPAC name: (3-tert-butylphenyl) N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]car...
Create Date: 2008-03-17
CID: 24749588

6042. CHEMBL240060; BDBM23014; N-arachidonoylserotonin carbamate analogue, 3e ...
MW:     366.453440 g/mol MF: C22H26N2O3
IUPAC name: (3-pentylphenyl) N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]carbama...
Create Date: 2008-03-17
CID: 24749586

6043. CHEMBL398984; BDBM23013; N-arachidonoylserotonin carbamate analogue, 3d ...
MW:     468.671260 g/mol MF: C29H44N2O3
IUPAC name: [(9Z,12Z)-octadeca-9,12-dienyl] N-[2-(5-hydroxy-1H-indol-3-y...
Create Date: 2008-03-17
CID: 24749490

6044. CHEMBL239850; BDBM23012; N-arachidonoylserotonin carbamate analogue, 3c ...
MW:     466.655380 g/mol MF: C29H42N2O3
IUPAC name: [(6Z,9Z,12Z)-octadeca-6,9,12-trienyl] N-[2-(5-hydroxy-1H-ind...
Create Date: 2008-03-17
CID: 24749489

6045. CHEMBL239849; BDBM23011; N-arachidonoylserotonin carbamate analogue, 3b ...
MW:     466.655380 g/mol MF: C29H42N2O3
IUPAC name: [(9Z,12Z,15Z)-octadeca-9,12,15-trienyl] N-[2-(5-hydroxy-1H-i...
Create Date: 2008-03-17
CID: 24749488

6046. CHEMBL239848; BDBM23010; N-arachidonoylserotonin carbamate analogue, 3a ...
MW:     492.692660 g/mol MF: C31H44N2O3
IUPAC name: [(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenyl] N-[2-(5-hydroxy-...
Create Date: 2008-03-17
CID: 24749487

6047. CHEMBL236589; BDBM23026; N-arachidonoylserotonin carbamate analogue, 3q ...
MW:     402.442480 g/mol MF: C24H22N2O4
IUPAC name: (4-phenylmethoxyphenyl) N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]...
Create Date: 2008-03-17
CID: 24749058

6048. CHEMBL241139; BDBM23024; ZINC14979791 ...
MW:     346.379220 g/mol MF: C21H18N2O3
IUPAC name: naphthalen-2-yl N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]carbamat...
Create Date: 2008-03-17
CID: 24749057

6049. CHEMBL241138; BDBM23022; N-arachidonoylserotonin carbamate analogue, 3m ...
MW:     422.217070 g/mol MF: C17H15IN2O3
IUPAC name: (3-iodophenyl) N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]carbamate
Create Date: 2008-03-17
CID: 24749056

6050. CHEMBL240275; BDBM23019; N-arachidonoylserotonin carbamate analogue, 3j ...
MW:     364.318510 g/mol MF: C18H15F3N2O3
IUPAC name: [4-(trifluoromethyl)phenyl] N-[2-(5-hydroxy-1H-indol-3-yl)et...
Create Date: 2008-03-17
CID: 24749055

6051. CHEMBL240062; BDBM23017; N-arachidonoylserotonin carbamate analogue, 3h
MW:     352.426860 g/mol MF: C21H24N2O3
IUPAC name: (4-tert-butylphenyl) N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]car...
Create Date: 2008-03-17
CID: 24749054

6052. CHEMBL194160; BDBM13919; pyrrolo[2,1-f][1,2,4]triazine analog 13 ...
MW:     425.485720 g/mol MF: C24H23N7O
IUPAC name: 2-[4-[(1-benzylindazol-5-yl)amino]-5-ethylpyrrolo[2,1-f][1,2...
Create Date: 2008-01-19
CID: 23646549

6053. CHEMBL196548; BDBM13918; pyrrolo[2,1-f][1,2,4]triazine analog 12 ...
MW:     426.513540 g/mol MF: C25H26N6O
IUPAC name: N-(1-benzylindazol-5-yl)-6-(ethoxymethyl)-5-ethylpyrrolo[2,1...
Create Date: 2008-01-19
CID: 23646548

6054. CHEMBL369967; BDBM13917; pyrrolo[2,1-f][1,2,4]triazine analog 11 ...
MW:     425.528780 g/mol MF: C25H27N7
IUPAC name: N-(1-benzylindazol-5-yl)-5-ethyl-6-(ethylaminomethyl)pyrrolo...
Create Date: 2008-01-19
CID: 23646547

6055. CHEMBL372692; BDBM13920; pyrrolo[2,1-f][1,2,4]triazine analog 14 ...
MW:     426.470480 g/mol MF: C24H22N6O2
IUPAC name: 2-[4-[(1-benzylindazol-5-yl)amino]-5-ethylpyrrolo[2,1-f][1,2...
Create Date: 2008-01-19
CID: 23644675

6056. CHEMBL373025; SCHEMBL4051441; BDBM13916 ...
MW:     398.460380 g/mol MF: C23H22N6O
IUPAC name: [4-[(1-benzylindazol-5-yl)amino]-5-ethylpyrrolo[2,1-f][1,2,4...
Create Date: 2007-12-05
CID: 21945809

6057. CHEMBL402489; SCHEMBL13593631; BDBM20645 ...
MW:     383.401140 g/mol MF: C19H21N5O4
IUPAC name: ethyl 4-[5-(methoxycarbamoyl)-2-methylanilino]-5-methylpyrro...
Create Date: 2007-09-10
CID: 16726210

6058. 89430-38-6; [D-Trp7,9,10]-Substance P; GPANTAGONIST-2A ...
MW:    1588.876900 g/mol MF: C79H105N21O13S
Create Date: 2007-07-04
CID: 16143852

6059. BDBM13926; hexahydrocyclopenta[b]furanyl urethane analog 4; (2R,3aR,6aS)-octahydropentalen-2-yl N-[(2S,3R)-3-hydroxy-4-{[4-(hydroxymethyl)benzene](2-methylpropyl)sulfonamido}-1-phenylbutan-2-yl]carbamate ...
MW:     558.729280 g/mol MF: C30H42N2O6S
IUPAC name: [(3aR,6aS)-1,2,3,3a,4,5,6,6a-octahydropentalen-2-yl] N-[(2S,...
Create Date: 2006-11-06
CID: 11849238

6060. SCHEMBL13345931; BDBM13924; hexahydrocyclopenta[b]furanyl urethane analog 2 ...
MW:     545.690760 g/mol MF: C28H39N3O6S
IUPAC name: [(3aS,5R,6aR)-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-...
Create Date: 2006-11-06
CID: 11849237

6061. GRL-06579A; CHEBI:46414; (3AS,5R,6AR)-HEXAHYDRO-2H-CYCLOPENTA[B]FURAN-5-YL (2S,3S)-3-HYDROXY-4-(4-(HYDROXYMETHYL)-N-ISOBUTYLPHENYLSULFONAMIDO)-1-PHENYLBUTAN-2-YLCARBAMATE ...
MW:     560.702100 g/mol MF: C29H40N2O7S
IUPAC name: [(3aS,5R,6aR)-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-...
Create Date: 2006-09-12
CID: 9547976

6062. CHEMBL379692; N-[(2R,3S)-3-AMINO-2-HYDROXY-4-PHENYLBUTYL]-4-METHOXY-2,3,6-TRIMETHYLBENZENESULFONAMIDE; C4M ...
MW:     392.512320 g/mol MF: C20H28N2O4S
IUPAC name: N-[(2R,3S)-3-amino-2-hydroxy-4-phenylbutyl]-4-methoxy-2,3,6-...
Create Date: 2006-08-16
CID: 9543487

6063. Boc-SAA-13-VV-OMe; CHEMBL433088; 126333-36-6 ...
MW:     784.844366 g/mol MF: C36H54F2N6O11
IUPAC name: methyl (2S)-2-[[(2S)-2-[[(4S)-2,2-difluoro-4-[[(2S)-2-[[(2S)...
Create Date: 2005-08-01
CID: 5479166

6064. SAA-9-VV-NH2; CHEMBL77621; 126380-78-7 ...
MW:     674.831260 g/mol MF: C33H54N8O7
IUPAC name: (2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-hydroxypro...
Create Date: 2005-08-01
CID: 5479164

6065. SAA-6-VV-OMe; 126453-25-6; AC1NUHV8 ...
MW:     704.853940 g/mol MF: C35H56N6O9
IUPAC name: methyl (2S)-2-[[(2S)-2-[[(1R,2R)-2-[(1R,2S)-2-[[(2S)-2-[[(2S...
Create Date: 2005-08-01
CID: 5479160

6066. SAA-5-VV-OMe; 126333-29-7; L-Valine, L-seryl-L-alanyl-L-alanyl-(1R,2R)-2-((1S,2S)-2-amino-1-hydroxy-3-phenylpropyl)cyclopentanecarbonyl-L-valyl-, methyl ester ...
MW:     704.853940 g/mol MF: C35H56N6O9
IUPAC name: methyl (2S)-2-[[(2S)-2-[[(1R,2R)-2-[(1S,2S)-2-[[(2S)-2-[[(2S...
Create Date: 2005-08-01
CID: 5479159

6067. BDBM3242; Modified Benzophenone Ring, Balanol Analog 42; (1R,2R)-2-[(4-hydroxybenzene)amido]cyclopentyl 3,5-dihydroxy-4-(8-hydroxy-4-oxo-3,4-dihydrophthalazin-1-yl)benzoate ...
MW:     517.486820 g/mol MF: C27H23N3O8
IUPAC name: [(1R,2R)-2-[(4-hydroxybenzoyl)amino]cyclopentyl] (4E)-5-hydr...
Create Date: 2006-01-30
CID: 5328001

6068. AC1NS3GZ; BDBM3209; Modified Benzophenone Ring, Balanol Analog 9 ...
MW:     540.561680 g/mol MF: C28H32N2O9
IUPAC name: (1R,2R)-2-[2,6-dihydroxy-4-[(3R,4R)-3-[(4-hydroxybenzoyl)ami...
Create Date: 2006-01-30
CID: 5327968

6069. GTP gamma-4-azidoanilide; 60869-76-3; GTP Gamma AA ...
MW:     639.303786 g/mol MF: C16H20N9O13P3
IUPAC name: [[[(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydro...
Create Date: 2005-06-01
CID: 656407

6070. PNU-32945; AC1L9X6Z; BDBM2311 ...
MW:     273.331800 g/mol MF: C18H15N3
IUPAC name: 2-(3-methyl-1,5-diphenylpyrazol-4-yl)acetonitrile
Create Date: 2005-08-01
CID: 477596

6071. 6-[2-[4-(trifluoromethyl)phenyl]ethyl]pteridine-2,4-diamine; AC1L9V1K; 10-deazaaminopterin 4- trifluoromethyl analog ...
MW:     334.299130 g/mol MF: C15H13F3N6
IUPAC name: 6-[2-[4-(trifluoromethyl)phenyl]ethyl]pteridine-2,4-diamine
Create Date: 2005-08-01
CID: 456510

6072. 6-[2-(3,4,5-trimethoxyphenyl)ethyl]pteridine-2,4-diamine; AC1L9V1H; FIWOPGKRFGDBPT-UHFFFAOYSA-N ...
MW:     356.379100 g/mol MF: C17H20N6O3
IUPAC name: 6-[2-(3,4,5-trimethoxyphenyl)ethyl]pteridine-2,4-diamine
Create Date: 2005-03-27
CID: 456509

6073. 147920-19-2; 1-(5-((N-(methyl)methylsulfonylamino)-2-indolyl)carbonyl)-4-(3-(isopropylamino)-2-pyridinyl)piperazine; 1-[5-[[N-(methyl)methylsulfonylamino]-2-indolyl]carbonyl]-4-[3-(isopropylamino)-2-pyridinyl]piperazine ...
MW:     470.587700 g/mol MF: C23H30N6O3S
IUPAC name: N-methyl-N-[2-[4-[3-(propan-2-ylamino)pyridin-2-yl]piperazin...
Create Date: 2005-08-01
CID: 454735

6074. 136817-78-2; METHANONE,[6-(HYDROXYMETHYL)-1H-INDOL-2-YL][4-[3-[(1-METHYLETHYL)AMINO]-2-PYRIDINYL]-1-PIPERAZINYL]-; Piperazine, 1-((6-(hydroxymethyl)-1H-indol-2-yl)carbonyl)-4-(3-((1-methylethyl)amino)-2-pyridinyl)- ...
MW:     393.482080 g/mol MF: C22H27N5O2
IUPAC name: [6-(hydroxymethyl)-1H-indol-2-yl]-[4-[3-(propan-2-ylamino)py...
Create Date: 2005-08-01
CID: 454734

6075. 147920-18-1; 1-[[6-(Methylsulfonyloxy)-2-indolyl]carbonyl]-4-[3-(isopropylamino)-2-pyridinyl]piperazine; 1-((6-(Methylsulfonyloxy)-2-indolyl)carbonyl)-4-(3-(isopropylamino)-2-pyridinyl)piperazine ...
MW:     457.545880 g/mol MF: C22H27N5O4S
IUPAC name: [2-[4-[3-(propan-2-ylamino)pyridin-2-yl]piperazine-1-carbony...
Create Date: 2005-08-01
CID: 454733

6076. 147920-17-0; 1-((6-(Methylsulfonylamino)-2-indolyl)carbonyl)-4-(3-(isopropylamino)-2-pyridinyl)piperazine; 1-[[6-(Methylsulfonylamino)-2-indolyl]carbonyl]-4-[3-(isopropylamino)-2-pyridinyl]piperazine ...
MW:     456.561120 g/mol MF: C22H28N6O3S
IUPAC name: N-[2-[4-[3-(propan-2-ylamino)pyridin-2-yl]piperazine-1-carbo...
Create Date: 2005-08-01
CID: 454732

6077. 147920-16-9; 1-[[5-(Trifluoromethylsulfonylamino)-2-indolyl]carbonyl]-4-[3-(isopropylamino)-2-pyridinyl]piperazine; 1-((5-(Trifluoromethylsulfonylamino)-2-indolyl)carbonyl)-4-(3-(isopropylamino)-2-pyridinyl)piperazine ...
MW:     510.532510 g/mol MF: C22H25F3N6O3S
IUPAC name: 1,1,1-trifluoro-N-[2-[4-[3-(propan-2-ylamino)pyridin-2-yl]pi...
Create Date: 2005-08-01
CID: 454731

6078. 147920-15-8; 1-((5-(Trifluoroacetylamino)-2-indolyl)carbonyl)-4-(3-(isopropylamino)-2-pyridinyl)piperazine; 1-[[5-(Trifluoroacetylamino)-2-indolyl]carbonyl]-4-[3-(isopropylamino)-2-pyridinyl]piperazine ...
MW:     474.478810 g/mol MF: C23H25F3N6O2
IUPAC name: 2,2,2-trifluoro-N-[2-[4-[3-(propan-2-ylamino)pyridin-2-yl]pi...
Create Date: 2005-08-01
CID: 454730

6079. 147920-14-7; 1-[[5-[(Methoxycarbonyl)amino]-2-indolyl]carbonyl]-4-[3-(isopropylamino)-2-pyridinyl]piperazine; 1-((5-((Methoxycarbonyl)amino)-2-indolyl)carbonyl)-4-(3-(isopropylamino)-2-pyridinyl)piperazine ...
MW:     436.506820 g/mol MF: C23H28N6O3
IUPAC name: methyl N-[2-[4-[3-(propan-2-ylamino)pyridin-2-yl]piperazine-...
Create Date: 2005-08-01
CID: 454729

6080. 136817-66-8; Piperazine, 1-((6-formyl-1H-indol-2-yl)carbonyl)-4-(3-((1-methylethyl)amino)-2-pyridinyl)-; 1-((6-Formyl-2-indolyl)carbonyl)-4-(3-(isopropylamino)-2-pyridinyl)piperazine ...
MW:     391.466200 g/mol MF: C22H25N5O2
IUPAC name: 2-[4-[3-(propan-2-ylamino)pyridin-2-yl]piperazine-1-carbonyl...
Create Date: 2005-08-01
CID: 454727

6081. 147920-11-4; 1-((6-Hydroxy-2-indolyl)carbonyl)-4-(3-(isopropylamino)-2-pyridinyl)piperazine; 1-[(6-Hydroxy-2-indolyl)carbonyl]-4-[3-(isopropylamino)-2-pyridinyl]piperazine ...
MW:     379.455500 g/mol MF: C21H25N5O2
IUPAC name: (6-hydroxy-1H-indol-2-yl)-[4-[3-(propan-2-ylamino)pyridin-2-...
Create Date: 2005-08-01
CID: 454725

6082. 147920-10-3; Piperazine, 1-(3-((1-methylethyl)amino)-2-pyridinyl)-4-((6-(phenylmethoxy)-1H-indol-2-yl)carbonyl)-; N-(6-Benzyloxy-2-indolcarbonyl)-N'-(3-(isopropylamino)-2-pyridinyl)piperazine ...
MW:     469.578040 g/mol MF: C28H31N5O2
IUPAC name: (6-phenylmethoxy-1H-indol-2-yl)-[4-[3-(propan-2-ylamino)pyri...
Create Date: 2005-08-01
CID: 453392

6083. 136817-84-0; Piperazine, 1-((6-fluoro-1H-indol-2-yl)carbonyl)-4-(3-((1-methylethyl)amino)-2-pyridinyl)-; N-(6-Fluoro-2-indolcarbonyl)-N'-(3-(isopropylamino)-2-pyridinyl)piperazine ...
MW:     381.446563 g/mol MF: C21H24FN5O
IUPAC name: (6-fluoro-1H-indol-2-yl)-[4-[3-(propan-2-ylamino)pyridin-2-y...
Create Date: 2005-08-01
CID: 453391

6084. 136817-42-0; Piperazine, 1-((6-methoxy-1H-indol-2-yl)carbonyl)-4-(3-((1-methylethyl)amino)-2-pyridinyl)-; N-(6-Methoxy-2-indolcarbonyl)-N'-(3-(isopropylamino)-2-pyridinyl)piperazine ...
MW:     393.482080 g/mol MF: C22H27N5O2
IUPAC name: (6-methoxy-1H-indol-2-yl)-[4-[3-(propan-2-ylamino)pyridin-2-...
Create Date: 2005-08-01
CID: 453390

6085. AC1L9QXY; BDBM2293; CHEMBL417331 ...
MW:     469.578040 g/mol MF: C28H31N5O2
IUPAC name: (5-phenylmethoxy-1H-indol-2-yl)-[4-[3-(propan-2-ylamino)pyri...
Create Date: 2005-08-01
CID: 453389

6086. 136817-58-8; Acetamide, N-(2-((4-(3-((1-methylethyl)amino)-2-pyridinyl)-1-piperazinyl)carbonyl)-1H-indol-5-yl)-; N-(5-(Acetylamino)-2-indolcarbonyl)-N'-(3-(isopropylamino)-2-pyridinyl)piperazine ...
MW:     420.507420 g/mol MF: C23H28N6O2
IUPAC name: N-[2-[4-[3-(propan-2-ylamino)pyridin-2-yl]piperazine-1-carbo...
Create Date: 2005-08-01
CID: 453388

6087. 136817-55-5; Piperazine, 1-((5-amino-1H-indol-2-yl)carbonyl)-4-(3-((1-methylethyl)amino)-2-pyridinyl)-; Piperazine, 1-[(5-amino-1H-indol-2-yl)carbonyl]-4-[3-[(1-methylethyl)amino]-2-pyridinyl]- ...
MW:     378.470740 g/mol MF: C21H26N6O
IUPAC name: (5-amino-1H-indol-2-yl)-[4-[3-(propan-2-ylamino)pyridin-2-yl...
Create Date: 2005-08-01
CID: 453387

6088. 136817-43-1; Piperazine, 1-(3-((1-methylethyl)amino)-2-pyridinyl)-4-((5-methyl-1H-indol-2-yl)carbonyl)-; N-(5-Methyl-2-indolcarbonyl)-N'-(3-(isopropylamino)-2-pyridinyl)piperazine ...
MW:     377.482680 g/mol MF: C22H27N5O
IUPAC name: (5-methyl-1H-indol-2-yl)-[4-[3-(propan-2-ylamino)pyridin-2-y...
Create Date: 2005-08-01
CID: 453386

6089. 136816-97-2; Piperazine, 1-((5-hydroxy-1H-indol-2-yl)carbonyl)-4-(3-((1-methylethyl)amino)-2-pyridinyl)-; 1-(3-(Isopropylamino)-2-pyridinyl)-4-((5-hydroxyindol-2-yl)carbonyl)piperazine ...
MW:     379.455500 g/mol MF: C21H25N5O2
IUPAC name: (5-hydroxy-1H-indol-2-yl)-[4-[3-(propan-2-ylamino)pyridin-2-...
Create Date: 2005-08-01
CID: 453385

6090. SAA-4-VV-OMe; CHEMBL49068; 126455-01-4 ...
MW:     664.790080 g/mol MF: C32H52N6O9
IUPAC name: methyl (2S)-2-[[(2S)-2-[[(4R,5S)-5-[[(2S)-2-[[(2S)-2-[[(2S)-...
Create Date: 2005-08-01
CID: 451632

6091. SAA-II-VV-OMe; CHEMBL297492; 126380-76-5 ...
MW:     664.790080 g/mol MF: C32H52N6O9
IUPAC name: methyl (2S)-2-[[(2S)-2-[[(4S,5S)-5-[[(2S)-2-[[(2S)-2-[[(2S)-...
Create Date: 2005-08-01
CID: 451629

6092. Skf 107457; 126333-28-6; methyl (2S)-2-[(2S)-2-[(4S,5S)-5-[(2S)-2-[(2S)-2-aminopropanamido]propanamido]-4-hydroxy-6-phenylhexanamido]-3-methylbutanamido]-3-methylbutanoate ...
MW:     577.712780 g/mol MF: C29H47N5O7
IUPAC name: methyl (2S)-2-[[(2S)-2-[[(4S,5S)-5-[[(2S)-2-[[(2S)-2-aminopr...
Create Date: 2005-06-24
CID: 444196

6093. 1-Isoquinolinyl phenyl ketone; 1-BENZOYLISOQUINOLINE; isoquinolin-1-yl(phenyl)methanone ...
MW:     233.264640 g/mol MF: C16H11NO
IUPAC name: isoquinolin-1-yl(phenyl)methanone
Create Date: 2005-03-26
CID: 280081

6094. 16576-32-2; 1-Isoquinolinecarbonitrile, 2-benzoyl-1,2-dihydro-1-methyl-; 2-benzoyl-1-methyl-1-isoquinolinecarbonitrile ...
MW:     274.316560 g/mol MF: C18H14N2O
IUPAC name: 2-benzoyl-1-methylisoquinoline-1-carbonitrile
Create Date: 2005-03-26
CID: 272339

6095. U 88204; U-88204; U-88204E ...
MW:     363.456100 g/mol MF: C21H25N5O
IUPAC name: 1H-indol-2-yl-[4-[3-(propan-2-ylamino)pyridin-2-yl]piperazin...
Create Date: 2005-08-01
CID: 72346

6096. Moexipril Methyl Ester Analog Hydrochloride Salt; [3S-[2-(S),3S]]-1,2,3,4-Tetrahydro-6,7-dimethoxy-2-[2-[[1-(methoxycarbonyl)-3-phenylpropyl]amino]-1-oxopropyl]-3-isoquinolinecarboxylic Acid Hydrochloride
MW:     521.002420 g/mol MF: C26H33ClN2O7
IUPAC name: (3R)-6,7-dimethoxy-2-[(2S)-2-[[(2S)-1-methoxy-1-oxo-4-phenyl...
Create Date: 2013-11-01
CID: 71750761

6097. SCHEMBL12340755; BDBM142097; US8933056, NVP-LAF237 analogue Thioxamide
MW:     338.273180 g/mol MF: C16H27BN2O3S
IUPAC name: [(2R)-1-[2-[(3-hydroxy-1-adamantyl)amino]ethanethioyl]pyrrol...
Create Date: 2012-08-19
CID: 57689722

6098. CHEMBL385504; BDBM50281658; cyclodextrin analogue of cyclic [p-I-Phe4]-DPDPE
MW:    2168.202250 g/mol MF: C92H147IN6O40S2
Create Date: 2009-11-19
CID: 44380390

6099. CHEMBL255084; BDBM20672; pyrrolo[2,1-f][1,2,4]triazine analogue, 21f ...
MW:     380.443560 g/mol MF: C20H24N6O2
IUPAC name: 4-(5-acetamido-2-methylanilino)-5-methyl-N-propylpyrrolo[2,1...
Create Date: 2008-03-24
CID: 24755455

6100. CHEMBL255083; BDBM20671; pyrrolo[2,1-f][1,2,4]triazine analogue, 21e ...
MW:     410.469540 g/mol MF: C21H26N6O3
IUPAC name: 4-[5-[(2-methoxyacetyl)amino]-2-methylanilino]-5-methyl-N-pr...
Create Date: 2008-03-24
CID: 24755454

6101. CHEMBL400185; BDBM20670; pyrrolo[2,1-f][1,2,4]triazine analogue, 21d ...
MW:     458.512340 g/mol MF: C25H26N6O3
IUPAC name: phenyl N-[4-methyl-3-[[5-methyl-6-(propylcarbamoyl)pyrrolo[2...
Create Date: 2008-03-24
CID: 24755453

6102. CHEMBL254661; BDBM20669; pyrrolo[2,1-f][1,2,4]triazine analogue, 21c ...
MW:     424.496120 g/mol MF: C22H28N6O3
IUPAC name: propan-2-yl N-[4-methyl-3-[[5-methyl-6-(propylcarbamoyl)pyrr...
Create Date: 2008-03-24
CID: 24755452

6103. CHEMBL254660; SCHEMBL12729391; BDBM20668 ...
MW:     410.469540 g/mol MF: C21H26N6O3
IUPAC name: ethyl N-[4-methyl-3-[[5-methyl-6-(propylcarbamoyl)pyrrolo[2,...
Create Date: 2008-03-24
CID: 24755391

6104. CHEMBL254659; BDBM20667; pyrrolo[2,1-f][1,2,4]triazine analogue, 21a ...
MW:     396.442960 g/mol MF: C20H24N6O3
IUPAC name: methyl N-[4-methyl-3-[[5-methyl-6-(propylcarbamoyl)pyrrolo[2...
Create Date: 2008-03-24
CID: 24755390

6105. CHEMBL253389; BDBM20663; pyrrolo[2,1-f][1,2,4]triazine analogue, 16 ...
MW:     411.457600 g/mol MF: C20H25N7O3
IUPAC name: N-methoxy-4-methyl-3-[[5-methyl-6-(propan-2-ylcarbamoylamino...
Create Date: 2008-03-24
CID: 24755388

6106. CHEMBL253149; BDBM20662; pyrrolo[2,1-f][1,2,4]triazine analogue, 15c ...
MW:     396.442960 g/mol MF: C20H24N6O3
IUPAC name: N-methoxy-4-methyl-3-[[5-methyl-6-(2-methylpropanoylamino)py...
Create Date: 2008-03-24
CID: 24755333

6107. CHEMBL253148; BDBM20661; pyrrolo[2,1-f][1,2,4]triazine analogue, 15b ...
MW:     382.416380 g/mol MF: C19H22N6O3
IUPAC name: N-methoxy-4-methyl-3-[[5-methyl-6-(propanoylamino)pyrrolo[2,...
Create Date: 2008-03-24
CID: 24755332

6108. CHEMBL252946; BDBM20660; pyrrolo[2,1-f][1,2,4]triazine analogue, 15a ...
MW:     368.389800 g/mol MF: C18H20N6O3
IUPAC name: 3-[(6-acetamido-5-methylpyrrolo[2,1-f][1,2,4]triazin-4-yl)am...
Create Date: 2008-03-24
CID: 24755331

6109. CHEMBL254453; BDBM20666; pyrrolo[2,1-f][1,2,4]triazine analogue, 17c ...
MW:     412.442360 g/mol MF: C20H24N6O4
IUPAC name: propan-2-yl N-[4-[5-(methoxycarbamoyl)-2-methylanilino]-5-me...
Create Date: 2008-03-24
CID: 24755328

6110. CHEMBL254452; BDBM20665; pyrrolo[2,1-f][1,2,4]triazine analogue, 17b ...
MW:     398.415780 g/mol MF: C19H22N6O4
IUPAC name: ethyl N-[4-[5-(methoxycarbamoyl)-2-methylanilino]-5-methylpy...
Create Date: 2008-03-24
CID: 24755252

6111. CHEMBL252569; BDBM20664; pyrrolo[2,1-f][1,2,4]triazine analogue, 17a ...
MW:     384.389200 g/mol MF: C18H20N6O4
IUPAC name: methyl N-[4-[5-(methoxycarbamoyl)-2-methylanilino]-5-methylp...
Create Date: 2008-03-24
CID: 24755251

6112. CHEMBL251930; SCHEMBL16576239; BDBM20648 ...
MW:     368.389800 g/mol MF: C18H20N6O3
IUPAC name: 4-[5-(methoxycarbamoyl)-2-methylanilino]-N,5-dimethylpyrrolo...
Create Date: 2008-03-24
CID: 24755250

6113. CHEMBL252373; BDBM20675; pyrrolo[2,1-f][1,2,4]triazine analogue, 21i ...
MW:     424.496120 g/mol MF: C22H28N6O3
IUPAC name: ethyl N-[3-[[6-[[(2S)-butan-2-yl]carbamoyl]-5-methylpyrrolo[...
Create Date: 2008-03-24
CID: 24754379

6114. CHEMBL252168; BDBM20674; pyrrolo[2,1-f][1,2,4]triazine analogue, 21h ...
MW:     410.469540 g/mol MF: C21H26N6O3
IUPAC name: ethyl N-[4-methyl-3-[[5-methyl-6-(propan-2-ylcarbamoyl)pyrro...
Create Date: 2008-03-24
CID: 24754378

6115. CHEMBL251972; BDBM20673; pyrrolo[2,1-f][1,2,4]triazine analogue, 21g ...
MW:     396.442960 g/mol MF: C20H24N6O3
IUPAC name: ethyl N-[3-[[6-(ethylcarbamoyl)-5-methylpyrrolo[2,1-f][1,2,4...
Create Date: 2008-03-24
CID: 24754377

6116. CHEMBL461495; SCHEMBL4669484; BDBM12914 ...
MW:     641.706943 g/mol MF: C32H36FN3O8S
IUPAC name: (5S)-3-(3-fluorophenyl)-N-[(2S,3R)-3-hydroxy-4-[(3-methoxyph...
Create Date: 2008-01-19
CID: 23646322

6117. CHEMBL510313; SCHEMBL4671707; BDBM12913 ...
MW:     623.716480 g/mol MF: C32H37N3O8S
IUPAC name: (5S)-N-[(2S,3R)-3-hydroxy-4-[(3-methoxyphenyl)sulfonyl-[[(2R...
Create Date: 2008-01-19
CID: 23646321

6118. BDBM10954; Conformationally Restricted Rivastigmine Analogue 6; (2S,6R)-3-methyl-8-oxa-3-azatricyclo[7.4.0.0^{2,6}]trideca-1(13),9,11-trien-10-yl N-(1-phenylethyl)carbamate hydrochloride ...
MW:     352.426860 g/mol MF: C21H24N2O3
IUPAC name: [(3aR,9bS)-1-methyl-3,3a,4,9b-tetrahydro-2H-chromeno[4,3-b]p...
Create Date: 2008-01-19
CID: 23645350

6119. CHEMBL375003; SCHEMBL4637233; BDBM12880 ...
MW:     580.695040 g/mol MF: C30H36N4O6S
IUPAC name: (5R)-N-[(2S,3R)-4-[(4-aminophenyl)sulfonyl-(2-methylpropyl)a...
Create Date: 2007-06-11
CID: 16078236

6120. CHEMBL219288; BDBM12879; N-Aryl-oxazolidinone-5-carboxamide Analogue 20a ...
MW:     595.706380 g/mol MF: C31H37N3O7S
IUPAC name: (5R)-N-[(2S,3R)-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-me...
Create Date: 2007-06-11
CID: 16078235

6121. CHEMBL269291; SCHEMBL8243639; BDBM12912 ...
MW:     701.732410 g/mol MF: C33H30F3N3O7S2
IUPAC name: (5S)-3-(4-acetylphenyl)-N-[(2S,3R)-3-hydroxy-1-phenyl-4-[thi...
Create Date: 2007-06-11
CID: 16078234

6122. CHEMBL375664; BDBM12911; N-Aryl-oxazolidinone-5-carboxamide Analogue 38b ...
MW:     677.686193 g/mol MF: C31H27F4N3O6S2
IUPAC name: (5S)-3-(3-fluorophenyl)-N-[(2S,3R)-3-hydroxy-1-phenyl-4-[thi...
Create Date: 2007-06-11
CID: 16078233

6123. CHEMBL412998; SCHEMBL4637342; BDBM12910 ...
MW:     659.695730 g/mol MF: C31H28F3N3O6S2
IUPAC name: (5S)-N-[(2S,3R)-3-hydroxy-1-phenyl-4-[thiophen-2-ylmethyl-(2...
Create Date: 2007-06-11
CID: 16078232

6124. CHEMBL220315; SCHEMBL12435427; BDBM12909 ...
MW:     677.787000 g/mol MF: C34H35N3O8S2
IUPAC name: (5S)-3-(4-acetylphenyl)-N-[(2S,3R)-3-hydroxy-4-[(3-methoxyph...
Create Date: 2007-06-11
CID: 16078231

6125. CHEMBL220455; SCHEMBL8244463; BDBM12908 ...
MW:     653.740783 g/mol MF: C32H32FN3O7S2
IUPAC name: (5S)-3-(3-fluorophenyl)-N-[(2S,3R)-3-hydroxy-4-[(3-methoxyph...
Create Date: 2007-06-11
CID: 16078230

6126. CHEMBL268117; SCHEMBL8247321; BDBM12907 ...
MW:     635.750320 g/mol MF: C32H33N3O7S2
IUPAC name: (5S)-N-[(2S,3R)-3-hydroxy-4-[(3-methoxyphenyl)sulfonyl-(thio...
Create Date: 2007-06-11
CID: 16078229

6127. CHEMBL220454; SCHEMBL8250054; BDBM12906 ...
MW:     635.727180 g/mol MF: C33H37N3O8S
IUPAC name: (5S)-3-(4-acetylphenyl)-N-[(2S,3R)-4-[cyclopropylmethyl-(4-m...
Create Date: 2007-06-11
CID: 16078228

6128. CHEMBL415592; BDBM12905; N-Aryl-oxazolidinone-5-carboxamide Analogue 36c ...
MW:     629.671426 g/mol MF: C31H33F2N3O7S
IUPAC name: (5S)-N-[(2S,3R)-4-[cyclopropylmethyl-(4-methoxyphenyl)sulfon...
Create Date: 2007-06-11
CID: 16078227

6129. CHEMBL413489; BDBM12904; N-Aryl-oxazolidinone-5-carboxamide Analogue 36b ...
MW:     611.680963 g/mol MF: C31H34FN3O7S
IUPAC name: (5S)-N-[(2S,3R)-4-[cyclopropylmethyl-(4-methoxyphenyl)sulfon...
Create Date: 2007-06-11
CID: 16078226

6130. CHEMBL415591; BDBM12903; N-Aryl-oxazolidinone-5-carboxamide Analogue 29f ...
MW:     637.743060 g/mol MF: C33H39N3O8S
IUPAC name: (5S)-3-(4-acetylphenyl)-N-[(2S,3R)-3-hydroxy-4-[(3-methoxyph...
Create Date: 2007-06-11
CID: 16078225

6131. CHEMBL266950; SCHEMBL4638252; BDBM12902 ...
MW:     595.706380 g/mol MF: C31H37N3O7S
IUPAC name: (5S)-N-[(2S,3R)-3-hydroxy-4-[(3-methoxyphenyl)sulfonyl-(2-me...
Create Date: 2007-06-11
CID: 16078224

6132. CHEMBL220079; SCHEMBL4638047; BDBM12901 ...
MW:     691.714450 g/mol MF: C33H36F3N3O8S
IUPAC name: (5S)-3-(3-acetylphenyl)-N-[(2S,3R)-3-hydroxy-4-[2-methylprop...
Create Date: 2007-06-11
CID: 16078223

6133. CHEMBL414279; SCHEMBL4638701; BDBM12900 ...
MW:     717.675739 g/mol MF: C32H33F6N3O7S
IUPAC name: (5S)-N-[(2S,3R)-3-hydroxy-4-[2-methylpropyl-[4-(trifluoromet...
Create Date: 2007-06-11
CID: 16078222

6134. CHEMBL385345; SCHEMBL4637390; BDBM12899 ...
MW:     655.733523 g/mol MF: C33H38FN3O8S
IUPAC name: (5S)-3-(4-acetylphenyl)-N-[(2S,3R)-4-[(3-fluoro-4-methoxyphe...
Create Date: 2007-06-11
CID: 16078221

6135. CHEMBL414057; SCHEMBL12513208; BDBM12898 ...
MW:     655.733523 g/mol MF: C33H38FN3O8S
IUPAC name: (5S)-3-(3-acetylphenyl)-N-[(2S,3R)-4-[(3-fluoro-4-methoxyphe...
Create Date: 2007-06-11
CID: 16078220

6136. CHEMBL385790; SCHEMBL12513203; BDBM12897 ...
MW:     681.694813 g/mol MF: C32H35F4N3O7S
IUPAC name: (5S)-N-[(2S,3R)-4-[(3-fluoro-4-methoxyphenyl)sulfonyl-(2-met...
Create Date: 2007-06-11
CID: 16078219

6137. CHEMBL414056; SCHEMBL4637385; BDBM12896 ...
MW:     649.677770 g/mol MF: C31H34F3N3O7S
IUPAC name: (5S)-3-(3,4-difluorophenyl)-N-[(2S,3R)-4-[(3-fluoro-4-methox...
Create Date: 2007-06-11
CID: 16078218

6138. CHEMBL266949; SCHEMBL4637341; BDBM12895 ...
MW:     631.687306 g/mol MF: C31H35F2N3O7S
IUPAC name: (5S)-N-[(2S,3R)-4-[(3-fluoro-4-methoxyphenyl)sulfonyl-(2-met...
Create Date: 2007-06-11
CID: 16078217

6139. CHEMBL385789; SCHEMBL4673706; BDBM12894 ...
MW:     651.726580 g/mol MF: C33H37N3O9S
IUPAC name: (5S)-3-(4-acetylphenyl)-N-[(2S,3R)-4-[1,3-benzodioxol-5-ylsu...
Create Date: 2007-06-11
CID: 16078216

6140. 3gi5; CHEMBL220078; SCHEMBL4671131 ...
MW:     651.726580 g/mol MF: C33H37N3O9S
IUPAC name: (5S)-3-(3-acetylphenyl)-N-[(2S,3R)-4-[1,3-benzodioxol-5-ylsu...
Create Date: 2007-06-11
CID: 16078215

6141. 3gi4; CHEMBL373518; SCHEMBL4671135 ...
MW:     677.687870 g/mol MF: C32H34F3N3O8S
IUPAC name: (5S)-N-[(2S,3R)-4-[1,3-benzodioxol-5-ylsulfonyl(2-methylprop...
Create Date: 2007-06-11
CID: 16078214

6142. CHEMBL220077; SCHEMBL4672930; BDBM12892 ...
MW:     645.670826 g/mol MF: C31H33F2N3O8S
IUPAC name: (5S)-N-[(2S,3R)-4-[1,3-benzodioxol-5-ylsulfonyl(2-methylprop...
Create Date: 2007-06-11
CID: 16078213

6143. CHEMBL266948; SCHEMBL4672756; BDBM12891 ...
MW:     627.680363 g/mol MF: C31H34FN3O8S
IUPAC name: (5S)-N-[(2S,3R)-4-[1,3-benzodioxol-5-ylsulfonyl(2-methylprop...
Create Date: 2007-06-11
CID: 16078212

6144. CHEMBL220076; SCHEMBL4637720; BDBM12890 ...
MW:     622.731720 g/mol MF: C32H38N4O7S
IUPAC name: (5S)-3-(4-acetylphenyl)-N-[(2S,3R)-4-[(4-aminophenyl)sulfony...
Create Date: 2007-06-11
CID: 16078211

6145. CHEMBL266947; BDBM12889; N-Aryl-oxazolidinone-5-carboxamide Analogue 25e ...
MW:     622.731720 g/mol MF: C32H38N4O7S
IUPAC name: (5S)-3-(3-acetylphenyl)-N-[(2S,3R)-4-[(4-aminophenyl)sulfony...
Create Date: 2007-06-11
CID: 16078210

6146. CHEMBL384440; BDBM12882; N-Aryl-oxazolidinone-5-carboxamide Analogue 25d ...
MW:     648.693010 g/mol MF: C31H35F3N4O6S
IUPAC name: (5S)-N-[(2S,3R)-4-[(4-aminophenyl)sulfonyl-(2-methylpropyl)a...
Create Date: 2007-06-11
CID: 16078209

6147. CHEMBL374709; SCHEMBL8249729; BDBM12888 ...
MW:     616.675966 g/mol MF: C30H34F2N4O6S
IUPAC name: (5S)-N-[(2S,3R)-4-[(4-aminophenyl)sulfonyl-(2-methylpropyl)a...
Create Date: 2007-06-11
CID: 16078208

6148. CHEMBL219913; SCHEMBL4782454; BDBM12887 ...
MW:     598.685503 g/mol MF: C30H35FN4O6S
IUPAC name: (5S)-N-[(2S,3R)-4-[(4-aminophenyl)sulfonyl-(2-methylpropyl)a...
Create Date: 2007-06-11
CID: 16078207

6149. CHEMBL218403; SCHEMBL4638044; BDBM12881 ...
MW:     580.695040 g/mol MF: C30H36N4O6S
IUPAC name: (5S)-N-[(2S,3R)-4-[(4-aminophenyl)sulfonyl-(2-methylpropyl)a...
Create Date: 2007-06-11
CID: 16078206

6150. CHEMBL384439; SCHEMBL4637645; BDBM12886 ...
MW:     625.732360 g/mol MF: C32H39N3O8S
IUPAC name: (5S)-N-[(2S,3R)-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-me...
Create Date: 2007-06-11
CID: 16078205

6151. 3gi6; CHEMBL382400; SCHEMBL4637319 ...
MW:     663.704350 g/mol MF: C32H36F3N3O7S
IUPAC name: (5S)-N-[(2S,3R)-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-me...
Create Date: 2007-06-11
CID: 16078204

6152. CHEMBL384437; SCHEMBL8246093; BDBM12876 ...
MW:     631.687306 g/mol MF: C31H35F2N3O7S
IUPAC name: (5S)-3-(3,4-difluorophenyl)-N-[(2S,3R)-3-hydroxy-4-[(4-metho...
Create Date: 2007-06-11
CID: 16078203

6153. CHEMBL219696; SCHEMBL4637317; BDBM12875 ...
MW:     613.696843 g/mol MF: C31H36FN3O7S
IUPAC name: (5S)-3-(3-fluorophenyl)-N-[(2S,3R)-3-hydroxy-4-[(4-methoxyph...
Create Date: 2007-06-11
CID: 16078202

6154. CHEMBL384436; SCHEMBL4638050; BDBM12884 ...
MW:     595.706380 g/mol MF: C31H37N3O7S
IUPAC name: (5S)-N-[(2S,3R)-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-me...
Create Date: 2007-06-11
CID: 16078201

6155. 2i0a; CHEMBL219748; SCHEMBL4637325 ...
MW:     637.743060 g/mol MF: C33H39N3O8S
IUPAC name: (5S)-3-(4-acetylphenyl)-N-[(2S,3R)-3-hydroxy-4-[(4-methoxyph...
Create Date: 2007-01-11
CID: 11987863

6156. 2i0d; CHEMBL384438; SCHEMBL4638081 ...
MW:     637.743060 g/mol MF: C33H39N3O8S
IUPAC name: (5S)-3-(3-acetylphenyl)-N-[(2S,3R)-3-hydroxy-4-[(4-methoxyph...
Create Date: 2007-01-10
CID: 11984567

6157. BDBM10955; Conformationally Restricted Rivastigmine Analogue 7; (2S,6R)-3-methyl-8-oxa-3-azatricyclo[7.4.0.0^{2,6}]trideca-1(13),9,11-trien-10-yl N-heptylcarbamate hydrochloride ...
MW:     346.463800 g/mol MF: C20H30N2O3
IUPAC name: [(3aR,9bS)-1-methyl-3,3a,4,9b-tetrahydro-2H-chromeno[4,3-b]p...
Create Date: 2006-10-26
CID: 11463218

6158. BDBM10956; Conformationally Restricted Rivastigmine Analogue 8; (2S,6R)-3-methyl-8-oxa-3-azatricyclo[7.4.0.0^{2,6}]trideca-1(13),9,11-trien-10-yl N-ethylcarbamate hydrochloride ...
MW:     276.330900 g/mol MF: C15H20N2O3
IUPAC name: [(3aR,9bS)-1-methyl-3,3a,4,9b-tetrahydro-2H-chromeno[4,3-b]p...
Create Date: 2006-10-26
CID: 11461127

6159. BDBM10953; Conformationally Restricted Rivastigmine Analogue 5; (2S,6R)-3-methyl-8-thia-3-azatricyclo[7.4.0.0^{2,6}]trideca-1(13),9,11-trien-10-yl N-methylcarbamate hydrochloride ...
MW:     278.369920 g/mol MF: C14H18N2O2S
IUPAC name: [(3aR,9bS)-1-methyl-3,3a,4,9b-tetrahydro-2H-thiochromeno[4,3...
Create Date: 2006-10-26
CID: 11460126

6160. BDBM10957; Conformationally Restricted Rivastigmine Analogue 9; (2S,6R)-3-methyl-3-azatricyclo[7.4.0.0^{2,6}]trideca-1(13),9,11-trien-10-yl N-ethylcarbamate hydrochloride ...
MW:     274.358080 g/mol MF: C16H22N2O2
IUPAC name: [(3aR,9bS)-1-methyl-2,3,3a,4,5,9b-hexahydrobenzo[g]indol-6-y...
Create Date: 2006-10-26
CID: 11381352

6161. BDBM10952; Conformationally Restricted Rivastigmine Analogue 4; (2S,6R)-3-methyl-3-azatricyclo[7.4.0.0^{2,6}]trideca-1(13),9,11-trien-10-yl N-methylcarbamate hydrochloride ...
MW:     260.331500 g/mol MF: C15H20N2O2
IUPAC name: [(3aR,9bS)-1-methyl-2,3,3a,4,5,9b-hexahydrobenzo[g]indol-6-y...
Create Date: 2006-10-26
CID: 11323955

6162. CHEMBL274107; BDBM10951; Conformationally Restricted Rivastigmine Analogue 3 ...
MW:     262.304320 g/mol MF: C14H18N2O3
IUPAC name: [(3aR,9bS)-1-methyl-3,3a,4,9b-tetrahydro-2H-chromeno[4,3-b]p...
Create Date: 2006-10-25
CID: 10515621

6163. CHEMBL252337; SCHEMBL4112666; BDBM20654 ...
MW:     422.480240 g/mol MF: C22H26N6O3
IUPAC name: N-cyclopentyl-4-[5-(methoxycarbamoyl)-2-methylanilino]-5-met...
Create Date: 2006-10-25
CID: 10295799

6164. 2rg6; CHEMBL252535; SCHEMBL4102133 ...
MW:     458.512340 g/mol MF: C25H26N6O3
IUPAC name: 4-[5-(methoxycarbamoyl)-2-methylanilino]-5-methyl-N-[(1S)-1-...
Create Date: 2006-10-25
CID: 10276213

6165. CHEMBL401210; SCHEMBL4111931; BDBM20652 ...
MW:     410.469540 g/mol MF: C21H26N6O3
IUPAC name: N-[(2S)-butan-2-yl]-4-[5-(methoxycarbamoyl)-2-methylanilino]...
Create Date: 2006-10-25
CID: 10223280

6166. CHEMBL401209; SCHEMBL4399819; BDBM20651 ...
MW:     396.442960 g/mol MF: C20H24N6O3
IUPAC name: 4-[5-(methoxycarbamoyl)-2-methylanilino]-5-methyl-N-propan-2...
Create Date: 2006-10-25
CID: 10222375

6167. CHEMBL252944; SCHEMBL4107597; BDBM20659 ...
MW:     467.520860 g/mol MF: C23H29N7O4
IUPAC name: 4-[5-(methoxycarbamoyl)-2-methylanilino]-5-methyl-N-(2-morph...
Create Date: 2006-10-25
CID: 10205267

6168. CHEMBL401164; SCHEMBL4412457; BDBM20650 ...
MW:     396.442960 g/mol MF: C20H24N6O3
IUPAC name: 4-[5-(methoxycarbamoyl)-2-methylanilino]-5-methyl-N-propylpy...
Create Date: 2006-10-25
CID: 10178871

6169. CHEMBL252739; SCHEMBL4106213; BDBM20658 ...
MW:     458.512340 g/mol MF: C25H26N6O3
IUPAC name: 4-[5-(methoxycarbamoyl)-2-methylanilino]-5-methyl-N-[(1R)-1-...
Create Date: 2006-10-25
CID: 10139311

6170. CHEMBL437971; SCHEMBL4106782; BDBM20655 ...
MW:     444.485760 g/mol MF: C24H24N6O3
IUPAC name: N-benzyl-4-[5-(methoxycarbamoyl)-2-methylanilino]-5-methylpy...
Create Date: 2006-10-25
CID: 10138392

6171. CHEMBL252336; SCHEMBL4406674; BDBM20653 ...
MW:     412.442360 g/mol MF: C20H24N6O4
IUPAC name: 4-[5-(methoxycarbamoyl)-2-methylanilino]-N-(2-methoxyethyl)-...
Create Date: 2006-10-25
CID: 10136387

6172. N-Ethyl-4-{[5-(Methoxycarbamoyl)-2-Methylphenyl]amino}-5-Methylpyrrolo[2,1-F][1,2,4]triazine-6-Carboxamide; 2rg5; CHEMBL252128 ...
MW:     382.416380 g/mol MF: C19H22N6O3
IUPAC name: N-ethyl-4-[5-(methoxycarbamoyl)-2-methylanilino]-5-methylpyr...
Create Date: 2006-10-25
CID: 10134493

6173. CHEMBL252533; SCHEMBL4101420; BDBM20656 ...
MW:     445.473820 g/mol MF: C23H23N7O3
IUPAC name: 4-[5-(methoxycarbamoyl)-2-methylanilino]-5-methyl-N-(pyridin...
Create Date: 2006-10-25
CID: 10114460

6174. CHEMBL231239; Pipemidic Acid - Ciprofloxacin Heterodimer Analog; 1-Cyclopropyl-4-oxo-6-fluoro-7-[4-[4-[4-(5-oxo-6-carboxy-8-ethyl-5,8-dihydropyrido[2,3-d]pyrimidine-2-yl)piperazinomethyl]benzyl]piperazino]-1,4-dihydroquinoline-3-carboxylic acid ...
MW:     736.791243 g/mol MF: C39H41FN8O6
IUPAC name: 2-[4-[[4-[[4-(3-carboxy-1-cyclopropyl-6-fluoro-4-oxoquinolin...
Create Date: 2006-10-25
CID: 10010208

6175. SAA-III-VV-OMe; 126380-77-6; L-Valine, N-(N-(4-hydroxy-6-(4-hydroxyphenyl)-1-oxo-5-((N-(N-L-seryl-L-alanyl)-L-alanyl)amino)hexyl)-L-valyl)-, methyl ester, (S-(R*,R*))- ...
MW:     680.789480 g/mol MF: C32H52N6O10
IUPAC name: methyl (2S)-2-[[(2S)-2-[[(4S,5S)-5-[[(2S)-2-[[(2S)-2-[[(2S)-...
Create Date: 2005-08-01
CID: 451631

6176. ATLa2; GTPL3383; ATL analog [15-epi-16-(para-fluoro)-phenoxy-LXA4] ...
MW:     404.471763 g/mol MF: C23H29FO5
IUPAC name: (5S,6R,7E,9E,11Z,13E,15S)-16-(4-fluorophenoxy)-5,6-dihydroxy...
Create Date: 2014-05-23
CID: 73755048

6177. BDBM97411; Phenylaminoacetic acid benzylidene hydrazine analog, 3; 2-(4-chloroanilino)-N-[(E)-(3,4-dimethoxyphenyl)methyleneamino]acetamide
MW:     347.796120 g/mol MF: C17H18ClN3O3
IUPAC name: 2-(4-chloroanilino)-N-[(E)-(3,4-dimethoxyphenyl)methylidenea...
Create Date: 2013-08-05
CID: 71624539

6178. BDBM97410; Phenylaminoacetic acid benzylidene hydrazine analog, 2; 2-anilino-N-[(E)-(3,4-dimethoxyphenyl)methyleneamino]acetamide
MW:     313.351060 g/mol MF: C17H19N3O3
IUPAC name: 2-anilino-N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]aceta...
Create Date: 2013-08-05
CID: 71624538

6179. postphotocycloaddition modified biyouyanagin analog 53; (1R,3S,4'S,5S,6S)-6-[(2,6-dichloropurin-7-yl)methyl]-4'-methyl-5-phenyl-4'-vinyl-spiro[4-oxabicyclo[3.2.0]heptane-3,3'-tetrahydrofuran]-2,2'-dione
MW:     499.346000 g/mol MF: C24H20Cl2N4O4
IUPAC name: (1R,3S,4'S,5S,6S)-6-[(2,6-dichloropurin-7-yl)methyl]-4'-ethe...
Create Date: 2013-07-09
CID: 71590957

6180. 2upj; AC1L9N3H; BDBM1939 ...
MW:     560.680500 g/mol MF: C33H40N2O6
IUPAC name: tert-butyl N-[3-[3-[(S)-cyclopropyl-[4-hydroxy-2-oxo-6-[(2R)...
Create Date: 2011-12-26
CID: 54689037

6181. AC1L9TLB; CHEMBL80529; BDBM1935 ...
MW:     508.562880 g/mol MF: C28H32N2O7
IUPAC name: tert-butyl N-[3-[3-[cyclopropyl-(4-hydroxy-7-methoxy-2-oxoch...
Create Date: 2011-12-26
CID: 54689033

6182. 2-Pyranone benzyl deriv.; 3-[cyclopropyl(phenyl)methyl]-4-hydroxy-7-methoxy-chromen-2-one; AC1L9TL8 ...
MW:     322.354520 g/mol MF: C20H18O4
IUPAC name: 3-[cyclopropyl(phenyl)methyl]-4-hydroxy-7-methoxychromen-2-o...
Create Date: 2011-12-26
CID: 54689032

6183. Phenprocoumon .b.AlaNH deriv.; AC1L9TL5; BDBM1933 ...
MW:     478.536900 g/mol MF: C27H30N2O6
IUPAC name: tert-butyl N-[3-[3-[cyclopropyl-(4-hydroxy-2-oxochromen-3-yl...
Create Date: 2011-12-26
CID: 54689031

6184. AC1L9TKZ; BDBM1931; CHEMBL120902 ...
MW:     496.552180 g/mol MF: C27H32N2O7
IUPAC name: tert-butyl N-[3-[3-[1-(4-hydroxy-7-methoxy-2-oxochromen-3-yl...
Create Date: 2011-12-26
CID: 54689030

6185. U03; 4-hydroxy-7-methoxy-3-(1-phenyl-propyl)-chromen-2-one; AC1L1C4R ...
MW:     310.343820 g/mol MF: C19H18O4
IUPAC name: 4-hydroxy-7-methoxy-3-(1-phenylpropyl)chromen-2-one
Create Date: 2011-12-26
CID: 54680110

6186. AC1L9TL2; BDBM1932; CHEMBL331618 ...
MW:     292.328540 g/mol MF: C19H16O3
IUPAC name: 3-[cyclopropyl(phenyl)methyl]-4-hydroxychromen-2-one
Create Date: 2011-12-26
CID: 54676406

6187. BDBM50040518; CID44372112; N-methylated analogue 17, Y-Trp-Nle-Asp-Phe-NHMe ...
MW:    1105.239200 g/mol MF: C53H70N9O15S-
IUPAC name: [4-[(2S)-3-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-[[(2S)-3-carboxy-1...
Create Date: 2009-11-19
CID: 44372112

6188. BDBM50091515; Aminoalkyl adenylate and aminoacyl sulfamate analogue
MW:     503.513380 g/mol MF: C16H27N10O7S+
IUPAC name: [(4S)-4-amino-5-[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-di...
Create Date: 2009-11-19
CID: 44298488

6189. Mycophenolate mofetil N-oxide; UNII-E48LN85F8Y; 224052-51-1 ...
MW:     449.494140 g/mol MF: C23H31NO8
IUPAC name: 2-(4-oxidomorpholin-4-ium-4-yl)ethyl (E)-6-(4-hydroxy-6-meth...
Create Date: 2009-05-28
CID: 29984917

6190. 64Cu-NAPamide; 64Cu-DOTA-NAPamide; 64Cu-[NIe4,Asp5,D-Phe7]-a-MSH4-11 ...
MW:    1549.574564 g/mol MF: C68H100CuN20O18
IUPAC name: (3S)-3-[[(2S)-2-acetamidohexanoyl]amino]-4-[[(2R)-1-[[(2S)-1...
Create Date: 2008-12-10
CID: 25082265

6191. 18F-NAPamide; 18F-FB-NAPamide; 18F-FB-[NIe4, Asp5, D-Phe7]-a-MSH4-11 ...
MW:    1220.343618 g/mol MF: C59H77FN16O12
IUPAC name: (3S)-3-[[(2S)-2-acetamidohexanoyl]amino]-4-[[(2R)-1-[[(2S)-1...
Create Date: 2008-12-10
CID: 25080109

6192. BDBM21747; Sunflower trypsin inhibitor-1(SFTI-1) analogue, 10
MW:    1589.878420 g/mol MF: C73H108N18O18S2
Create Date: 2008-12-10
CID: 25079271

6193. BDBM21746; Sunflower trypsin inhibitor-1(SFTI-1) analogue, 9
MW:    1563.841140 g/mol MF: C71H106N18O18S2
Create Date: 2008-12-10
CID: 25079270

6194. BDBM21741; Sunflower trypsin inhibitor-1(SFTI-1) analogue, 4
MW:    1561.825260 g/mol MF: C71H104N18O18S2
Create Date: 2008-12-10
CID: 25079269

6195. BDBM21739; Sunflower trypsin inhibitor-1(SFTI-1) analogue, 2
MW:    1541.795860 g/mol MF: C67H104N20O18S2
Create Date: 2008-12-10
CID: 25079268

6196. NSC609697; NSC-609697; 1,1-cyclobutanecarboxylic acid analog of silaplatin
MW:     455.446300 g/mol MF: C10H20N2O4PtSi+2
IUPAC name: [aminomethyl(dimethyl)silyl]methanamine;cyclobutane-1,1-dica...
Create Date: 2008-02-29
CID: 24201953

6197. BDBM21749; Sunflower trypsin inhibitor-1(SFTI-1) analogue, 12
MW:    1527.809040 g/mol MF: C68H106N18O18S2
Create Date: 2008-02-19
CID: 23731257

6198. BDBM21744; Sunflower trypsin inhibitor-1(SFTI-1) analogue, 7
MW:    1483.667140 g/mol MF: C67H106N18O20
Create Date: 2008-02-19
CID: 23731157

6199. BDBM21748; Sunflower trypsin inhibitor-1(SFTI-1) analogue, 11
MW:    1603.734776 g/mol MF: C67H99F5N18O18S2
Create Date: 2008-02-19
CID: 23730933

6200. BDBM21745; Sunflower trypsin inhibitor-1(SFTI-1) analogue, 8
MW:    1528.754040 g/mol MF: C66H101N19O19S2
Create Date: 2008-02-19
CID: 23730697

6201. BDBM21743; Sunflower trypsin inhibitor-1(SFTI-1) analogue, 6
MW:    1527.809040 g/mol MF: C68H106N18O18S2
Create Date: 2008-02-19
CID: 23730696

6202. BDBM21742; Sunflower trypsin inhibitor-1(SFTI-1) analogue, 5
MW:    1514.767220 g/mol MF: C67H103N17O19S2
Create Date: 2008-02-19
CID: 23730589

6203. BDBM21740; Sunflower trypsin inhibitor-1(SFTI-1) analogue, 3
MW:    1499.755880 g/mol MF: C66H102N18O18S2
Create Date: 2008-02-19
CID: 23730588

6204. BDBM21751; Sunflower trypsin inhibitor-1(SFTI-1) analogue, 14
MW:    1527.809040 g/mol MF: C68H106N18O18S2
Create Date: 2008-02-19
CID: 23729674

6205. BDBM21750; Sunflower trypsin inhibitor-1(SFTI-1) analogue, 13
MW:    1527.809040 g/mol MF: C68H106N18O18S2
Create Date: 2008-02-19
CID: 23729580

6206. CHEMBL392204; BDBM19267; Mycophenolic Adenine Dinucleotide (MAD) Analogue, 38 ...
MW:     673.502744 g/mol MF: C25H33N5O13P2
IUPAC name: [(2R,3S,4R,5R)-5-(6-amino-2-ethylpurin-9-yl)-3,4-dihydroxyox...
Create Date: 2008-01-19
CID: 23648229

6207. CHEMBL410745; BDBM19266; Mycophenolic Adenine Dinucleotide (MAD) Analogue, 37 ...
MW:     721.545544 g/mol MF: C29H33N5O13P2
IUPAC name: [(2R,3S,4R,5R)-5-(6-amino-2-phenylpurin-9-yl)-3,4-dihydroxyo...
Create Date: 2008-01-19
CID: 23648228

6208. CHEMBL392203; BDBM19263; Tiazofurin Adenine Dinucleotide (TAD) Analogue, 33 ...
MW:     697.505984 g/mol MF: C21H29N7O14P2S
IUPAC name: [[(2R,3S,4R,5R)-5-(6-amino-2-ethylpurin-9-yl)-3,4-dihydroxyo...
Create Date: 2008-01-19
CID: 23648227

6209. CHEMBL429702; BDBM19262; Tiazofurin Adenine Dinucleotide (TAD) Analogue, 32 ...
MW:     695.490104 g/mol MF: C21H27N7O14P2S
IUPAC name: [[(2R,3S,4R,5R)-5-(6-amino-2-ethenylpurin-9-yl)-3,4-dihydrox...
Create Date: 2008-01-19
CID: 23648226

6210. CHEMBL235533; BDBM19261; Tiazofurin Adenine Dinucleotide (TAD) Analogue, 31 ...
MW:     693.474224 g/mol MF: C21H25N7O14P2S
IUPAC name: [[(2R,3S,4R,5R)-5-(6-amino-2-ethynylpurin-9-yl)-3,4-dihydrox...
Create Date: 2008-01-19
CID: 23648225

6211. CHEMBL265870; BDBM19259; Tiazofurin Adenine Dinucleotide (TAD) Analogue, 29 ...
MW:     774.590004 g/mol MF: C26H32N8O14P2S
IUPAC name: [[(2R,3S,4R,5R)-5-[6-amino-2-(benzylamino)purin-9-yl]-3,4-di...
Create Date: 2008-01-19
CID: 23648224

6212. CHEMBL441190; BDBM19258; Tiazofurin Adenine Dinucleotide (TAD) Analogue, 28 ...
MW:     760.563424 g/mol MF: C25H30N8O14P2S
IUPAC name: [[(2R,3S,4R,5R)-5-(6-amino-2-anilinopurin-9-yl)-3,4-dihydrox...
Create Date: 2008-01-19
CID: 23648223

6213. CHEMBL409560; BDBM19257; Tiazofurin Adenine Dinucleotide (TAD) Analogue, 27 ...
MW:     684.467464 g/mol MF: C19H26N8O14P2S
IUPAC name: [[(2R,3S,4R,5R)-5-(4-carbamoyl-1,3-thiazol-2-yl)-3,4-dihydro...
Create Date: 2008-01-19
CID: 23648222

6214. CHEMBL264107; BDBM19256; Tiazofurin Adenine Dinucleotide (TAD) Analogue, 26 ...
MW:     745.548784 g/mol MF: C25H29N7O14P2S
IUPAC name: [[(2R,3S,4R,5R)-5-(6-amino-2-phenylpurin-9-yl)-3,4-dihydroxy...
Create Date: 2008-01-19
CID: 23648221

6215. CHEMBL394277; BDBM19255; Tiazofurin Adenine Dinucleotide (TAD) Analogue, 25 ...
MW:     795.349354 g/mol MF: C19H24IN7O14P2S
IUPAC name: [[(2R,3S,4R,5R)-5-(6-amino-2-iodopurin-9-yl)-3,4-dihydroxyox...
Create Date: 2008-01-19
CID: 23648220

6216. CHEMBL349963; BDBM10054; 19-Heteromethyl-Substituted Androstenedione Analog 14 ...
MW:     406.580200 g/mol MF: C26H30O2S
IUPAC name: (10R,13S)-13-methyl-10-(2-phenylsulfanylethyl)-2,6,7,8,12,14...
Create Date: 2008-01-19
CID: 23645033

6217. CHEMBL164821; BDBM10053; 19-Heteromethyl-Substituted Androstenedione Analog 41 ...
MW:     453.475200 g/mol MF: C26H30O2Se
IUPAC name: (10R,13S)-13-methyl-10-(2-phenylselanylethyl)-2,6,7,8,12,14,...
Create Date: 2008-01-19
CID: 23645032

6218. CHEMBL424185; BDBM10052; 19-Heteromethyl-Substituted Androstenedione Analog 40 ...
MW:     392.509020 g/mol MF: C21H28O5S
IUPAC name: 2-[(10R,13S)-13-methyl-3,17-dioxo-2,6,7,8,12,14,15,16-octahy...
Create Date: 2008-01-19
CID: 23645031

6219. CHEMBL166060; BDBM10051; 19-Heteromethyl-Substituted Androstenedione Analog 42 ...
MW:     424.315770 g/mol MF: C20H25IO2
IUPAC name: (10R,13S)-10-(2-iodoethyl)-13-methyl-2,6,7,8,12,14,15,16-oct...
Create Date: 2008-01-19
CID: 23645030

6220. CHEMBL165925; BDBM10050; 19-Heteromethyl-Substituted Androstenedione Analog 39 ...
MW:     328.445220 g/mol MF: C21H28O3
IUPAC name: (10R,13S)-10-(2-methoxyethyl)-13-methyl-2,6,7,8,12,14,15,16-...
Create Date: 2008-01-19
CID: 23645029

6221. CHEMBL166017; BDBM10049; 19-Heteromethyl-Substituted Androstenedione Analog 38 ...
MW:     341.487040 g/mol MF: C22H31NO2
IUPAC name: (10R,13S)-10-[2-(dimethylamino)ethyl]-13-methyl-2,6,7,8,12,1...
Create Date: 2008-01-19
CID: 23645028

6222. CHEMBL414564; BDBM19260; Tiazofurin Adenine Dinucleotide (TAD) Analogue, 30 ...
MW:     788.616584 g/mol MF: C27H34N8O14P2S
IUPAC name: [[(2R,3S,4R,5R)-5-[6-amino-2-(2-phenylethylamino)purin-9-yl]...
Create Date: 2008-01-19
CID: 23644735

6223. SCHEMBL774450; CHEMBL216448; BDBM13243 ...
MW:     374.500340 g/mol MF: C19H26N4O2S
IUPAC name: 2-(tert-butylcarbamoylamino)-4-methyl-N-(2,4,6-trimethylphen...
Create Date: 2007-12-05
CID: 21985486

6224. CHEMBL131346; SCHEMBL773918; BDBM13242 ...
MW:     374.500340 g/mol MF: C19H26N4O2S
IUPAC name: 2-(butylcarbamoylamino)-4-methyl-N-(2,4,6-trimethylphenyl)-1...
Create Date: 2007-12-05
CID: 21985432

6225. SCHEMBL773890; CHEMBL217506; BDBM13233 ...
MW:     369.437460 g/mol MF: C19H19N3O3S
IUPAC name: 2-(furan-3-carbonylamino)-4-methyl-N-(2,4,6-trimethylphenyl)...
Create Date: 2007-12-05
CID: 21985424

6226. SCHEMBL772657; CHEMBL405630; BDBM13262 ...
MW:     325.388200 g/mol MF: C16H15N5OS
IUPAC name: N-(2,6-dimethylphenyl)-2-(pyridazin-3-ylamino)-1,3-thiazole-...
Create Date: 2007-12-05
CID: 21911645

6227. CHEMBL186568; SCHEMBL774786; BDBM13266 ...
MW:     358.845200 g/mol MF: C17H15ClN4OS
IUPAC name: N-(2-chloro-6-methylphenyl)-2-[(4-methylpyridin-2-yl)amino]-...
Create Date: 2007-12-05
CID: 21911623

6228. CHEMBL127500; SCHEMBL773972; BDBM13237 ...
MW:     375.829360 g/mol MF: C17H14ClN3O3S
IUPAC name: N-(2-chloro-6-methylphenyl)-2-(furan-2-carbonylamino)-4-meth...
Create Date: 2007-12-05
CID: 21911611

6229. CHEMBL128377; SCHEMBL772332; BDBM13239 ...
MW:     349.835140 g/mol MF: C16H16ClN3O2S
IUPAC name: N-(2-chloro-6-methylphenyl)-2-(cyclopropanecarbonylamino)-4-...
Create Date: 2007-12-05
CID: 21911609

6230. SCHEMBL774561; CHEMBL407005; BDBM13261 ...
MW:     345.806680 g/mol MF: C15H12ClN5OS
IUPAC name: N-(2-chloro-6-methylphenyl)-2-(pyridazin-3-ylamino)-1,3-thia...
Create Date: 2007-12-05
CID: 21911599

6231. SCHEMBL774811; CHEMBL386745; BDBM13259 ...
MW:     324.400140 g/mol MF: C17H16N4OS
IUPAC name: N-(2,6-dimethylphenyl)-2-(pyridin-2-ylamino)-1,3-thiazole-5-...
Create Date: 2007-12-05
CID: 21911586

6232. SCHEMBL772798; CHEMBL217486; BDBM13235 ...
MW:     391.894960 g/mol MF: C17H14ClN3O2S2
IUPAC name: N-(2-chloro-6-methylphenyl)-4-methyl-2-(thiophene-3-carbonyl...
Create Date: 2007-12-05
CID: 21911584

6233. SCHEMBL774608; CHEMBL384822; BDBM13236 ...
MW:     391.894960 g/mol MF: C17H14ClN3O2S2
IUPAC name: N-(2-chloro-6-methylphenyl)-4-methyl-2-(thiophene-2-carbonyl...
Create Date: 2007-12-05
CID: 21911582

6234. CHEMBL214028; SCHEMBL1540000; BDBM13223 ...
MW:     317.405960 g/mol MF: C16H19N3O2S
IUPAC name: 2-acetamido-4-methyl-N-(2,4,6-trimethylphenyl)-1,3-thiazole-...
Create Date: 2007-12-05
CID: 21911563

6235. CHEMBL360810; SCHEMBL773145; BDBM13258 ...
MW:     344.818620 g/mol MF: C16H13ClN4OS
IUPAC name: N-(2-chloro-6-methylphenyl)-2-(pyridin-4-ylamino)-1,3-thiazo...
Create Date: 2007-12-05
CID: 21911520

6236. CHEMBL130719; SCHEMBL773819; BDBM13224 ...
MW:     379.475340 g/mol MF: C21H21N3O2S
IUPAC name: 2-benzamido-4-methyl-N-(2,4,6-trimethylphenyl)-1,3-thiazole-...
Create Date: 2007-12-05
CID: 21911517

6237. CHEMBL130160; SCHEMBL775446; BDBM13245 ...
MW:     380.892240 g/mol MF: C17H21ClN4O2S
IUPAC name: 2-(butylcarbamoylamino)-N-(2-chloro-6-methylphenyl)-4-methyl...
Create Date: 2007-12-05
CID: 21911491

6238. CHEMBL186564; SCHEMBL773900; BDBM13269 ...
MW:     373.859840 g/mol MF: C17H16ClN5OS
IUPAC name: N-(2-chloro-6-methylphenyl)-2-[(4,6-dimethylpyrimidin-2-yl)a...
Create Date: 2007-12-05
CID: 21911457

6239. CHEMBL189675; SCHEMBL773817; BDBM13257 ...
MW:     344.818620 g/mol MF: C16H13ClN4OS
IUPAC name: N-(2-chloro-6-methylphenyl)-2-(pyridin-3-ylamino)-1,3-thiazo...
Create Date: 2007-12-05
CID: 21911439

6240. SCHEMBL774793; CHEMBL215630; BDBM13244 ...
MW:     408.516560 g/mol MF: C22H24N4O2S
IUPAC name: 2-(benzylcarbamoylamino)-4-methyl-N-(2,4,6-trimethylphenyl)-...
Create Date: 2007-12-05
CID: 21911412

6241. CHEMBL338159; SCHEMBL773691; BDBM13240 ...
MW:     332.420600 g/mol MF: C16H20N4O2S
IUPAC name: 4-methyl-2-(methylcarbamoylamino)-N-(2,4,6-trimethylphenyl)-...
Create Date: 2007-12-05
CID: 21911406

6242. CHEMBL365505; SCHEMBL774162; BDBM13265 ...
MW:     358.845200 g/mol MF: C17H15ClN4OS
IUPAC name: N-(2-chloro-6-methylphenyl)-2-[(6-methylpyridin-2-yl)amino]-...
Create Date: 2007-12-05
CID: 21911345

6243. CHEMBL188478; SCHEMBL773310; BDBM13267 ...
MW:     372.871780 g/mol MF: C18H17ClN4OS
IUPAC name: N-(2-chloro-6-methylphenyl)-2-[(4,6-dimethylpyridin-2-yl)ami...
Create Date: 2007-12-05
CID: 21911338

6244. SCHEMBL774481; CHEMBL384545; BDBM13263 ...
MW:     373.859840 g/mol MF: C17H16ClN5OS
IUPAC name: N-(2-chloro-6-methylphenyl)-2-[(3,5-dimethylpyrazin-2-yl)ami...
Create Date: 2007-12-05
CID: 21911333

6245. CHEMBL385191; SCHEMBL1540048; BDBM13231 ...
MW:     359.485700 g/mol MF: C19H25N3O2S
IUPAC name: 2-(2,2-dimethylpropanoylamino)-4-methyl-N-(2,4,6-trimethylph...
Create Date: 2007-12-05
CID: 21911296

6246. SCHEMBL772868; CHEMBL386371; BDBM13260 ...
MW:     338.426720 g/mol MF: C18H18N4OS
IUPAC name: 2-(pyridin-2-ylamino)-N-(2,4,6-trimethylphenyl)-1,3-thiazole...
Create Date: 2007-12-05
CID: 21911293

6247. CHEMBL131661; SCHEMBL773591; BDBM13232 ...
MW:     369.437460 g/mol MF: C19H19N3O3S
IUPAC name: 2-(furan-2-carbonylamino)-4-methyl-N-(2,4,6-trimethylphenyl)...
Create Date: 2007-12-05
CID: 21911271

6248. SCHEMBL774309; CHEMBL384307; BDBM13270 ...
MW:     367.467940 g/mol MF: C19H21N5OS
IUPAC name: 2-[(2,6-dimethylpyrimidin-4-yl)amino]-N-(2,4,6-trimethylphen...
Create Date: 2007-12-05
CID: 21911267

6249. CHEMBL189776; SCHEMBL774932; BDBM13256 ...
MW:     344.818620 g/mol MF: C16H13ClN4OS
IUPAC name: N-(2-chloro-6-methylphenyl)-2-(pyridin-2-ylamino)-1,3-thiazo...
Create Date: 2007-12-05
CID: 21911266

6250. CHEMBL337985; SCHEMBL773400; BDBM13238 ...
MW:     385.867240 g/mol MF: C19H16ClN3O2S
IUPAC name: 2-benzamido-N-(2-chloro-6-methylphenyl)-4-methyl-1,3-thiazol...
Create Date: 2007-12-05
CID: 21911241

6251. SCHEMBL772812; CHEMBL217565; BDBM13234 ...
MW:     385.503060 g/mol MF: C19H19N3O2S2
IUPAC name: 4-methyl-2-(thiophene-3-carbonylamino)-N-(2,4,6-trimethylphe...
Create Date: 2007-12-05
CID: 21911235

6252. SCHEMBL772892; CHEMBL385172; BDBM13264 ...
MW:     339.414780 g/mol MF: C17H17N5OS
IUPAC name: 2-(pyrazin-2-ylamino)-N-(2,4,6-trimethylphenyl)-1,3-thiazole...
Create Date: 2007-12-05
CID: 21911223

6253. CHEMBL128589; SCHEMBL14568864; BDBM13222 ...
MW:     333.405360 g/mol MF: C16H19N3O3S
IUPAC name: methyl N-[4-methyl-5-[(2,4,6-trimethylphenyl)carbamoyl]-1,3-...
Create Date: 2007-12-05
CID: 21137651

6254. CHEMBL214949; SCHEMBL5858353; BDBM13230 ...
MW:     409.501320 g/mol MF: C22H23N3O3S
IUPAC name: benzyl N-[4-methyl-5-[(2,4,6-trimethylphenyl)carbamoyl]-1,3-...
Create Date: 2007-12-05
CID: 21137645

6255. SCHEMBL774311; CHEMBL217195; BDBM13241 ...
MW:     394.489980 g/mol MF: C21H22N4O2S
IUPAC name: 4-methyl-2-(phenylcarbamoylamino)-N-(2,4,6-trimethylphenyl)-...
Create Date: 2007-11-13
CID: 16897096

6256. BDBM9104; CHEMBL439513; 3-(5-methyl-2-furyl)-4-methylpyridine analog 22 ...
MW:     837.282970 g/mol MF: C42H44ClF3N6O7
IUPAC name: (2S)-4-[[5-(4-chlorophenyl)-1,3-oxazol-2-yl]methyl]-1-[(2S,4...
Create Date: 2007-03-08
CID: 15955620

6257. BDBM9103; CHEMBL370179; 3-(5-methyl-2-furyl)-4-methylpyridine analog 21 ...
MW:     852.360510 g/mol MF: C43H45ClF3N5O6S
IUPAC name: (2S)-4-[[5-(4-chlorophenyl)thiophen-2-yl]methyl]-1-[(2S,4S)-...
Create Date: 2007-03-08
CID: 15955619

6258. BDBM9102; CHEMBL372527; 3-(5-methyl-2-furyl)-4-methylpyridine analog 20 ...
MW:     881.401730 g/mol MF: C44H48ClF3N6O6S
IUPAC name: (2S)-4-[2-[5-(4-chlorophenyl)-1,3-thiazol-2-yl]propan-2-yl]-...
Create Date: 2007-03-08
CID: 15955618

6259. BDBM9101; CHEMBL198531; 3-(5-methyl-2-furyl)-4-methylpyridine analog 19 ...
MW:     836.294910 g/mol MF: C43H45ClF3N5O7
IUPAC name: (2S)-4-[[5-(4-chlorophenyl)furan-2-yl]methyl]-1-[(2S,4S)-2-h...
Create Date: 2007-03-08
CID: 15955617

6260. BDBM9100; CHEMBL197114; 3-(5-methyl-2-furyl)-4-methylpyridine analog 18 ...
MW:     836.893973 g/mol MF: C42H44F4N6O6S
IUPAC name: (2S)-4-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl]-1-[(2S,...
Create Date: 2007-03-08
CID: 15955616

6261. SCHEMBL773125; CHEMBL217039; BDBM13275 ...
MW:     444.937740 g/mol MF: C20H21ClN6O2S
IUPAC name: N-(2-chloro-6-methylphenyl)-2-[(2-methyl-6-morpholin-4-ylpyr...
Create Date: 2006-10-26
CID: 11775143

6262. GTPL712; CHEMBL178083; compound (S)-3h [PMID: 15686947] ...
MW:     370.872520 g/mol MF: C21H23ClN2O2
IUPAC name: 2-[(2R)-3-[(2S)-2-benzylpyrrolidin-1-yl]-2-hydroxypropoxy]-6...
Create Date: 2006-10-26
CID: 11710462

6263. CHEMBL189649; SCHEMBL773606; BDBM13274 ...
MW:     430.911160 g/mol MF: C19H19ClN6O2S
IUPAC name: N-(2-chloro-6-methylphenyl)-2-[(6-morpholin-4-ylpyrimidin-4-...
Create Date: 2006-10-26
CID: 11487256

6264. SCHEMBL774731; CHEMBL214617; BDBM13276 ...
MW:     502.032120 g/mol MF: C23H28ClN7O2S
IUPAC name: N-(2-chloro-6-methylphenyl)-2-[[2-methyl-6-(3-morpholin-4-yl...
Create Date: 2006-10-26
CID: 11466196

6265. SCHEMBL773124; CHEMBL386118; BDBM13277 ...
MW:     418.900460 g/mol MF: C18H19ClN6O2S
IUPAC name: N-(2-chloro-6-methylphenyl)-2-[[6-(2-hydroxyethylamino)-2-me...
Create Date: 2006-10-26
CID: 11407465

6266. SCHEMBL774800; CHEMBL424906; BDBM13273 ...
MW:     467.974380 g/mol MF: C22H22ClN7OS
IUPAC name: N-(2-chloro-6-methylphenyl)-2-[[6-(3-imidazol-1-ylpropylamin...
Create Date: 2006-10-26
CID: 11328827

6267. SCHEMBL774490; CHEMBL273250; BDBM13272 ...
MW:     487.017480 g/mol MF: C23H27ClN6O2S
IUPAC name: N-(2-chloro-6-methylphenyl)-2-[[6-(3-morpholin-4-ylpropylami...
Create Date: 2006-10-26
CID: 11283174

6268. SCHEMBL773489; CHEMBL216240; BDBM13278 ...
MW:     472.990900 g/mol MF: C22H25ClN6O2S
IUPAC name: N-(2-chloro-6-methylphenyl)-2-[[6-[4-(hydroxymethyl)piperidi...
Create Date: 2006-10-26
CID: 11260009

6269. SCHEMBL775095; CHEMBL385698; BDBM13271 ...
MW:     403.885820 g/mol MF: C18H18ClN5O2S
IUPAC name: N-(2-chloro-6-methylphenyl)-2-[[6-(2-hydroxyethylamino)pyrid...
Create Date: 2006-10-26
CID: 11200510

6270. CHEMBL364623; N-(2-chloro-6-methylphenyl)-2-[(2,6-dimethylpyrimidin-4-yl)amino]-1,3-thiazole-5-carboxamide; SCHEMBL774220 ...
MW:     373.859840 g/mol MF: C17H16ClN5OS
IUPAC name: N-(2-chloro-6-methylphenyl)-2-[(2,6-dimethylpyrimidin-4-yl)a...
Create Date: 2006-10-26
CID: 11153014

6271. CHEMBL412045; BDBM50112098; analog of Angiotensin II with cis vinyl sulfide bridge
MW:    1046.158720 g/mol MF: C48H63N13O12S
IUPAC name: (3S)-3-amino-4-[[(2S)-1-[[(3R,6S,9S,12Z)-9-[[(2S)-1-[(2S)-2-...
Create Date: 2006-10-25
CID: 10011335

6272. BDBM97415; ZINC33399659; AKOS024344785 ...
MW:     253.299100 g/mol MF: C15H15N3O
IUPAC name: 2-anilino-N-[(E)-benzylideneamino]acetamide
Create Date: 2006-10-24
CID: 9660764

6273. ST4005679; BDBM97416; MolPort-002-685-754 ...
MW:     332.195160 g/mol MF: C15H14BrN3O
IUPAC name: 2-anilino-N-[(E)-(3-bromophenyl)methylideneamino]acetamide
Create Date: 2006-10-24
CID: 9595691

6274. SCHEMBL12793483; BDBM97414; MolPort-003-707-177 ...
MW:     314.357363 g/mol MF: C17H19FN4O
IUPAC name: N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]-2-(4-fluor...
Create Date: 2006-10-23
CID: 9557240

6275. BDBM97412; MolPort-002-689-920; MolPort-019-736-922 ...
MW:     287.744160 g/mol MF: C15H14ClN3O
IUPAC name: N-[(E)-benzylideneamino]-2-(4-chloroanilino)acetamide
Create Date: 2006-10-23
CID: 9557026

6276. AC1OB1ZR; BDBM97409; HMS1608H08 ...
MW:     287.744160 g/mol MF: C15H14ClN3O
IUPAC name: 2-anilino-N-[(E)-(2-chlorophenyl)methylideneamino]acetamide
Create Date: 2006-07-03
CID: 6871012

6277. AC1O6WN7; 2-(4-Fluoroanilino)-N'-((2-hydroxyphenyl)methylene)acetohydrazide; 2-(4-fluoroanilino)-N'-[(2-hydroxyphenyl)methylene]acetohydrazide ...
MW:     287.288963 g/mol MF: C15H14FN3O2
IUPAC name: 2-(4-fluoroanilino)-N'-[(E)-(6-oxocyclohexa-2,4-dien-1-ylide...
Create Date: 2006-05-04
CID: 6537254

6278. Ac-SAA-9-VV-NH2; 126333-32-2; L-Valinamide, 1-(2-((N-(N-(N-acetyl-L-seryl)-L-alanyl)-L-alanyl)amino)-3-phenylpropyl)-L-prolyl-L-valyl-, (S)- ...
MW:     716.867940 g/mol MF: C35H56N8O8
IUPAC name: (2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-acetamido-3-hydrox...
Create Date: 2005-08-01
CID: 5479163

6279. Boc-SAA-8-VV-OMe; 127470-77-3; AC1NUHVE ...
MW:     804.969760 g/mol MF: C40H64N6O11
IUPAC name: methyl (2S)-2-[[(2S)-2-[[(1S,2S)-2-[(1R,2S)-1-hydroxy-2-[[(2...
Create Date: 2005-08-01
CID: 5479162

6280. Boc-SAA-7-VV-OMe; 126333-30-0; AC1NUHVB ...
MW:     804.969760 g/mol MF: C40H64N6O11
IUPAC name: methyl (2S)-2-[[(2S)-2-[[(1S,2S)-2-[(1S,2S)-1-hydroxy-2-[[(2...
Create Date: 2005-08-01
CID: 5479161

6281. BDBM97428; Phenylaminoacetic acid benzylidene hydrazine analog, 21; N-[(E)-(3-bromophenyl)methyleneamino]-2-(3-chloroanilino)acetamide
MW:     366.640220 g/mol MF: C15H13BrClN3O
IUPAC name: N-[(E)-(3-bromophenyl)methylideneamino]-2-(3-chloroanilino)a...
Create Date: 2013-09-18
CID: 71699769

6282. BDBM97427; Phenylaminoacetic acid benzylidene hydrazine analog, 20; 2-(3-chloroanilino)-N-[(E)-(2-chlorophenyl)methyleneamino]acetamide
MW:     322.189220 g/mol MF: C15H13Cl2N3O
IUPAC name: 2-(3-chloroanilino)-N-[(E)-(2-chlorophenyl)methylideneamino]...
Create Date: 2013-09-18
CID: 71699768

6283. BDBM97422; Phenylaminoacetic acid benzylidene hydrazine analog, 15
MW:     384.630683 g/mol MF: C15H12BrClFN3O
IUPAC name: N-[(E)-(3-bromophenyl)methylideneamino]-2-(2-chloro-3-fluoro...
Create Date: 2013-09-18
CID: 71699767

6284. BDBM97421; Phenylaminoacetic acid benzylidene hydrazine analog, 14
MW:     340.179683 g/mol MF: C15H12Cl2FN3O
IUPAC name: 2-(2-chloro-3-fluoroanilino)-N-[(E)-(2-chlorophenyl)methylid...
Create Date: 2013-09-18
CID: 71699766

6285. BDBM97420; Phenylaminoacetic acid benzylidene hydrazine analog, 13
MW:     305.734623 g/mol MF: C15H13ClFN3O
IUPAC name: N-[(E)-benzylideneamino]-2-(2-chloro-3-fluoroanilino)acetami...
Create Date: 2013-09-18
CID: 71699765

6286. BDBM97419; Phenylaminoacetic acid benzylidene hydrazine analog, 12
MW:     321.734023 g/mol MF: C15H13ClFN3O2
IUPAC name: 2-(2-chloro-3-fluoroanilino)-N'-[(E)-(6-oxocyclohexa-2,4-die...
Create Date: 2013-09-18
CID: 71699764

6287. Enalapril Impurity H; Enalapril Cyclohexyl Analogue Trifluoroacetic Acid Salt; (2S)-1-[(2S)-2-[[(1S)-3-Cyclohexyl-1-(ethoxycarbonyl)propyl]amino]propanoyl]pyrrolidine-2-carboxylic Acid Trifluoroacetic Acid Salt ...
MW:     496.517710 g/mol MF: C22H35F3N2O7
IUPAC name: (2S)-1-[(2S)-2-[[(2S)-4-cyclohexyl-1-ethoxy-1-oxobutan-2-yl]...
Create Date: 2013-05-17
CID: 71316328

6288. AC1LA3KX; BDBM1942; CHEMBL331595 ...
MW:     780.928220 g/mol MF: C43H48N4O8S
IUPAC name: tert-butyl N-[(2S)-1-[3-[cyclopropyl-[4-hydroxy-2-oxo-6-(1-p...
Create Date: 2011-12-26
CID: 54689040

6289. AC1O3EDF; BDBM1941; CHEMBL122768 ...
MW:     560.680500 g/mol MF: C33H40N2O6
IUPAC name: tert-butyl N-[(2S)-1-[3-[cyclopropyl-[4-hydroxy-2-oxo-6-(1-p...
Create Date: 2011-12-26
CID: 54689039

6290. N-[3-[Cyclopropyl[4-hydroxy-2-oxo-6-[1-(phenylmethyl)propyl]-2H-pyran-3-yl]methyl]phenyl]-(4-pyridyl)acetamide; AC1LA3KR; BDBM1940 ...
MW:     508.607480 g/mol MF: C32H32N2O4
IUPAC name: N-[3-[cyclopropyl-[4-hydroxy-2-oxo-6-(1-phenylbutan-2-yl)pyr...
Create Date: 2011-12-26
CID: 54689038

6291. AC1LA3L0; BDBM1943; CHEMBL120225 ...
MW:     626.741880 g/mol MF: C36H42N4O6
IUPAC name: tert-butyl N-[(2S)-1-[3-[cyclopropyl-[4-hydroxy-2-oxo-6-(1-p...
Create Date: 2011-12-26
CID: 54680270

6292. CTK2F3550; 5-Heptenoic acid, 7-(6-(3-hydroxy-1-octenyl)-2,3-diazabicyclo(2.2.1)hept-2-en-5-yl)-; 67901-99-9
MW:     348.479680 g/mol MF: C20H32N2O3
IUPAC name: 7-[5-(3-hydroxyoct-1-enyl)-2,3-diazabicyclo[2.2.1]hept-2-en-...
Create Date: 2011-12-04
CID: 54461377

6293. BDBM50193488; CID44415033; truncated aminoglycoside-coenzyme A bisubstrate analogue 4f ...
MW:     946.753146 g/mol MF: C30H49N10O17P3S-4
IUPAC name: [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[[[(3R)-3-...
Create Date: 2009-11-19
CID: 44415033

6294. BDBM50193478; CID44415032; truncated aminoglycoside-coenzyme A bisubstrate analogue 4e ...
MW:     932.726566 g/mol MF: C29H47N10O17P3S-4
IUPAC name: [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[[[(3R)-3-...
Create Date: 2009-11-19
CID: 44415032

6295. BDBM50193487; CID44415026; truncated aminoglycoside-coenzyme A bisubstrate analogue 4d ...
MW:     962.795606 g/mol MF: C31H53N10O17P3S-4
IUPAC name: [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-2-[[[[(3R)-4-[[3-[2-[2-...
Create Date: 2009-11-19
CID: 44415026

6296. BDBM50193475; CID44415025; truncated aminoglycoside-coenzyme A bisubstrate analogue 4c ...
MW:     976.739366 g/mol MF: C29H47N12O18P3S-4
IUPAC name: [(2R,3S,4R,5R)-2-[[[[(3R)-4-[[3-[2-[2-[[(2S)-1-amino-5-(diam...
Create Date: 2009-11-19
CID: 44415025

6297. BDBM50193483; CID44415024; truncated aminoglycoside-coenzyme A bisubstrate analogue 1c ...
MW:    1153.934366 g/mol MF: C37H62N11O23P3S-4
IUPAC name: [(2R,3S,4R,5R)-2-[[[[(3R)-4-[[3-[2-[4-[[(2R,3S,4R,5R,6R)-5-a...
Create Date: 2009-11-19
CID: 44415024

6298. BDBM50193476; CID44415023; truncated aminoglycoside-coenzyme A bisubstrate analogue 1b ...
MW:    1139.907786 g/mol MF: C36H60N11O23P3S-4
IUPAC name: [(2R,3S,4R,5R)-2-[[[[(3R)-4-[[3-[2-[3-[[(2R,3S,4R,5R,6R)-5-a...
Create Date: 2009-11-19
CID: 44415023

6299. BDBM50193486; CID44415022; truncated aminoglycoside-coenzyme A bisubstrate analogue 1a ...
MW:    1125.881206 g/mol MF: C35H58N11O23P3S-4
IUPAC name: [(2R,3S,4R,5R)-2-[[[[(3R)-4-[[3-[2-[2-[[(2R,3S,4R,5R,6R)-5-a...
Create Date: 2009-11-19
CID: 44415022

6300. BDBM50193485; CID44414954; truncated aminoglycoside-coenzyme A bisubstrate analogue 4b ...
MW:    1005.773986 g/mol MF: C32H50N9O20P3S-4
IUPAC name: [(2R,3S,4R,5R)-2-[[[[(3R)-4-[[3-[2-[2-[[(5S)-5-acetamido-6-m...
Create Date: 2009-11-19
CID: 44414954

6301. BDBM50193484; CID44414951; truncated aminoglycoside-coenzyme A bisubstrate analogue 4a ...
MW:     995.736106 g/mol MF: C30H48N9O21P3S-4
IUPAC name: [(2R,3S,4R,5R)-2-[[[[(3R)-4-[[3-[2-[2-[[(2R,3S,4R,5R,6S)-5-a...
Create Date: 2009-11-19
CID: 44414951

6302. BDBM50193479; CID44414949; truncated aminoglycoside-coenzyme A bisubstrate analogue 3
MW:    1420.136426 g/mol MF: C46H76N11O32P3S-4
IUPAC name: [(2R,3S,4R,5R)-2-[[[[(3R)-4-[[3-[2-[2-[[(2R,3S,4R,5R,6R)-5-a...
Create Date: 2009-11-19
CID: 44414949

6303. BDBM50193482; CID44414946; truncated aminoglycoside-coenzyme A bisubstrate analogue 2
MW:    1288.021806 g/mol MF: C41H68N11O28P3S-4
IUPAC name: [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-2-[[[[(3R)-4-[[3-[2-[2-...
Create Date: 2009-11-19
CID: 44414946

6304. BDBM50193481; CID44414945; truncated aminoglycoside-coenzyme A bisubstrate analogue 1d ...
MW:    1167.960946 g/mol MF: C38H64N11O23P3S-4
IUPAC name: [(2R,3S,4R,5R)-2-[[[[(3R)-4-[[3-[2-[5-[[(2R,3S,4R,5R,6R)-5-a...
Create Date: 2009-11-19
CID: 44414945

6305. BDBM33961; dihydroxy benzoyl naphthyl hydrazone (DHBNH) analogue, 8
MW:     420.931200 g/mol MF: C25H25ClN2O2
IUPAC name: 4-(4-chlorophenyl)-N-[(E)-(2-methoxynaphthalen-1-yl)methylid...
Create Date: 2009-11-17
CID: 44263381

6306. BDBM33960; dihydroxy benzoyl naphthyl hydrazone (DHBNH) analogue, 7
MW:     396.437900 g/mol MF: C25H20N2O3
IUPAC name: N-[(E)-(2-methoxynaphthalen-1-yl)methylideneamino]-4-phenoxy...
Create Date: 2009-11-17
CID: 44263380

6307. BDBM33957; dihydroxy benzoyl naphthyl hydrazone (DHBNH) analogue, 4
MW:     347.410340 g/mol MF: C21H21N3O2
IUPAC name: 4-(dimethylamino)-N-[(E)-(2-methoxynaphthalen-1-yl)methylide...
Create Date: 2009-11-17
CID: 44263379

6308. O-Methyl mycophenolate mofetil; UNII-1540AFX387; 1322681-37-7 ...
MW:     447.521320 g/mol MF: C24H33NO7
IUPAC name: 2-morpholin-4-ylethyl (E)-6-(4,6-dimethoxy-7-methyl-3-oxo-1H...
Create Date: 2009-05-28
CID: 29983936

6309. SCHEMBL772202; CHEMBL217507; BDBM13251 ...
MW:     377.868380 g/mol MF: C16H12ClN3O2S2
IUPAC name: N-(2-chloro-6-methylphenyl)-2-(thiophene-2-carbonylamino)-1,...
Create Date: 2007-12-05
CID: 21911573

6310. SCHEMBL774803; CHEMBL214712; BDBM13247 ...
MW:     323.797860 g/mol MF: C14H14ClN3O2S
IUPAC name: N-(2-chloro-6-methylphenyl)-2-(propanoylamino)-1,3-thiazole-...
Create Date: 2007-12-05
CID: 21911570

6311. SCHEMBL773376; CHEMBL386167; BDBM13252 ...
MW:     377.868380 g/mol MF: C16H12ClN3O2S2
IUPAC name: N-(2-chloro-6-methylphenyl)-2-(thiophene-3-carbonylamino)-1,...
Create Date: 2007-12-05
CID: 21911536

6312. CHEMBL131393; SCHEMBL773593; BDBM13250 ...
MW:     371.840660 g/mol MF: C18H14ClN3O2S
IUPAC name: 2-benzamido-N-(2-chloro-6-methylphenyl)-1,3-thiazole-5-carbo...
Create Date: 2007-12-05
CID: 21911468

6313. SCHEMBL772749; CHEMBL217570; BDBM13254 ...
MW:     349.835140 g/mol MF: C16H16ClN3O2S
IUPAC name: N-(2-chloro-6-methylphenyl)-2-(cyclobutanecarbonylamino)-1,3...
Create Date: 2007-12-05
CID: 21911393

6314. SCHEMBL774161; CHEMBL384596; BDBM13248 ...
MW:     349.835140 g/mol MF: C16H16ClN3O2S
IUPAC name: N-(2-chloro-6-methylphenyl)-2-[(1-methylcyclopropanecarbonyl...
Create Date: 2007-12-05
CID: 21911389

6315. SCHEMBL773797; CHEMBL213763; BDBM13249 ...
MW:     349.835140 g/mol MF: C16H16ClN3O2S
IUPAC name: N-(2-chloro-6-methylphenyl)-2-[(2-methylcyclopropanecarbonyl...
Create Date: 2007-12-05
CID: 21911371

6316. CHEMBL128070; SCHEMBL774962; BDBM13253 ...
MW:     361.802780 g/mol MF: C16H12ClN3O3S
IUPAC name: N-(2-chloro-6-methylphenyl)-2-(furan-2-carbonylamino)-1,3-th...
Create Date: 2007-12-05
CID: 21911324

6317. SCHEMBL774304; CHEMBL408027; BDBM13255 ...
MW:     363.861720 g/mol MF: C17H18ClN3O2S
IUPAC name: N-(2-chloro-6-methylphenyl)-2-(cyclopentanecarbonylamino)-1,...
Create Date: 2007-12-05
CID: 21911283

6318. UNII-0SDH06DWVW; Tsukubamycin B; Dihydro FK-506 ...
MW:     806.034040 g/mol MF: C44H71NO12
Create Date: 2007-02-08
CID: 13819087

6319. CHEMBL266450; BDBM50112097; analog of Angiotensin II with trans vinyl sulfide bridge
MW:    1046.158720 g/mol MF: C48H63N13O12S
IUPAC name: (3S)-3-amino-4-[[(2S)-1-[[(3R,6S,9S,12E)-9-[[(2S)-1-[(2S)-2-...
Create Date: 2006-10-25
CID: 10079766

6320. CHEMBL131577; SCHEMBL774726; BDBM13246 ...
MW:     335.808560 g/mol MF: C15H14ClN3O2S
IUPAC name: N-(2-chloro-6-methylphenyl)-2-(cyclopropanecarbonylamino)-1,...
Create Date: 2006-10-25
CID: 9927718

6321. BDBM33958; AKOS002934822; dihydroxy benzoyl naphthyl hydrazone (DHBNH) analogue, 5
MW:     360.448860 g/mol MF: C23H24N2O2
IUPAC name: 4-tert-butyl-N-[(E)-(2-methoxynaphthalen-1-yl)methylideneami...
Create Date: 2006-10-24
CID: 9672271

6322. BDBM97426; ZINC33374519; AKOS024344776 ...
MW:     287.744160 g/mol MF: C15H14ClN3O
IUPAC name: N-[(E)-benzylideneamino]-2-(3-chloroanilino)acetamide
Create Date: 2006-10-24
CID: 9661749

6323. AmbscC-088612; BDBM97424; Phenylaminoacetic acid benzylidene hydrazine analog, 17 ...
MW:     366.640220 g/mol MF: C15H13BrClN3O
IUPAC name: N-[(E)-(3-bromophenyl)methylideneamino]-2-(4-chloroanilino)a...
Create Date: 2006-10-24
CID: 9655234

6324. AG-205/32982004; N'-[(2-methoxy-1-naphthyl)methylene]-4-methylbenzohydrazide; CHEMBL3103231 ...
MW:     318.369120 g/mol MF: C20H18N2O2
IUPAC name: N-[(E)-(2-methoxynaphthalen-1-yl)methylideneamino]-4-methylb...
Create Date: 2006-10-23
CID: 9563336

6325. AG-205/32982006; 4-methoxy-N'-[(2-methoxy-1-naphthyl)methylene]benzohydrazide; ARONIS018287 ...
MW:     334.368520 g/mol MF: C20H18N2O3
IUPAC name: 4-methoxy-N-[(E)-(2-methoxynaphthalen-1-yl)methylideneamino]...
Create Date: 2006-10-23
CID: 9562835

6326. BDBM97425; MolPort-003-707-183; ZINC33296400 ...
MW:     305.734623 g/mol MF: C15H13ClFN3O
IUPAC name: N-[(E)-(2-chlorophenyl)methylideneamino]-2-(4-fluoroanilino)...
Create Date: 2006-10-23
CID: 9557243

6327. ST50987179; AC1OB1ZC; BDBM97418 ...
MW:     296.366900 g/mol MF: C17H20N4O
IUPAC name: 2-anilino-N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]a...
Create Date: 2006-07-03
CID: 6871007

6328. AC1O42XF; BDBM97423; STK699547 ...
MW:     303.743560 g/mol MF: C15H14ClN3O2
IUPAC name: 2-(4-chloroanilino)-N'-[(E)-(6-oxocyclohexa-2,4-dien-1-ylide...
Create Date: 2005-11-21
CID: 6322042

6329. AC1O12BI; BDBM97417; AKOS024344790 ...
MW:     269.298500 g/mol MF: C15H15N3O2
IUPAC name: 2-anilino-N'-[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]...
Create Date: 2005-09-14
CID: 6084462

6330. AC1NX265; BDBM33954; T629E ...
MW:     304.342540 g/mol MF: C19H16N2O2
IUPAC name: N-[(E)-(2-methoxynaphthalen-1-yl)methylideneamino]benzamide
Create Date: 2005-07-28
CID: 5718502

6331. AN-329/10735045; AC1NSD52; ARONIS016316 ...
MW:     380.438500 g/mol MF: C25H20N2O2
IUPAC name: N-[(E)-(2-methoxynaphthalen-1-yl)methylideneamino]-4-phenylb...
Create Date: 2006-02-02
CID: 5332319

6332. Cdk1/2 Inhibitor III; 443798-55-8; 5-AMINO-3-{[4-(AMINOSULFONYL)PHENYL]AMINO}-N-(2,6-DIFLUOROPHENYL)-1H-1,2,4-TRIAZOLE-1-CARBOTHIOAMIDE ...
MW:     425.436226 g/mol MF: C15H13F2N7O2S2
IUPAC name: 5-amino-N-(2,6-difluorophenyl)-3-(4-sulfamoylanilino)-1,2,4-...
Create Date: 2006-01-30
CID: 5330812

6333. JNJ-7706621; 443797-96-4; JNJ7706621 ...
MW:     394.355986 g/mol MF: C15H12F2N6O3S
IUPAC name: 4-[[5-amino-1-(2,6-difluorobenzoyl)-1,2,4-triazol-3-yl]amino...
Create Date: 2006-01-30
CID: 5330790

6334. AC1MHJM0; Heterodimer [d4U]N^3-N-piperazinyl[trovirdine analogue; 1-(5-bromo-2-pyridyl)-3-[2-[4-[4-[3-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]-2,6-dioxo-pyrimidin-1-yl]but-2-ynyl]piperazin-1-yl]ethyl]thiourea ...
MW:     604.519200 g/mol MF: C25H30BrN7O4S
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-[4-[4-[3-[(2R,5S)-5-(hydroxymet...
Create Date: 2005-08-01
CID: 3005920

6335. AC1LA1SY; CHEMBL270066; CTK7E1290 ...
MW:     473.166346 g/mol MF: C10H14N5O11P3
IUPAC name: [(2R,5R)-5-(6-aminopurin-9-yl)-2,5-dihydrofuran-2-yl]oxymeth...
Create Date: 2005-08-01
CID: 479996

6336. NSC713788; AC1L8GSH; NSC-713788 ...
MW:     249.265800 g/mol MF: C12H15N3O3
IUPAC name: (2R,3S,5R)-2-(hydroxymethyl)-5-(7-methylimidazo[4,5-b]pyridi...
Create Date: 2005-03-26
CID: 401060

6337. 1,5-Bis(2-hydroxyphenyl)penta-1,4-dien-3-one; AC1L3ZX0; SCHEMBL1160537 ...
MW:     266.291260 g/mol MF: C17H14O3
IUPAC name: 1,5-bis(2-hydroxyphenyl)penta-1,4-dien-3-one
Create Date: 2005-03-26
CID: 98176

6338. N-(2-Guanidinoethyl)-4-methylpiperidine; 46235-00-1; 4-SAG ...
MW:     184.281900 g/mol MF: C9H20N4
IUPAC name: 2-[2-(4-methylpiperidin-1-yl)ethyl]guanidine
Create Date: 2005-08-08
CID: 26494

6339. BDBM91645; 2,3,4,5-Tetrahydro-1,5-benzothiazepine analog (2S,4R), 7
MW:     351.437123 g/mol MF: C21H18FNOS
IUPAC name: 2-[2-(4-fluorophenyl)-2,3,4,5-tetrahydro-1,5-benzothiazepin-...
Create Date: 2008-07-14
CID: 24850350

6340. BDBM91644; 2,3,4,5-Tetrahydro-1,5-benzothiazepine analog (2S,4R), 6
MW:     333.446660 g/mol MF: C21H19NOS
IUPAC name: 2-(2-phenyl-2,3,4,5-tetrahydro-1,5-benzothiazepin-4-yl)pheno...
Create Date: 2008-07-14
CID: 24850349

6341. 1094322-91-4; 1-(2-(4-Morpholinyl)ethoxy) mycophenolate mofetil; 1-[2-(4-Morpholinyl)ethoxy] Mycophenolate Mofetil ...
MW:     562.651780 g/mol MF: C29H42N2O9
IUPAC name: 2-morpholin-4-ylethyl (E)-6-[4-hydroxy-6-methoxy-7-methyl-1-...
Create Date: 2009-02-09
CID: 25144924

6342. AC1MHJM9; Heterodimer [d4T]N^3-(CH2)6-N-piperazinyl[trovirdine analogue]; 1-(5-bromo-2-pyridyl)-3-[2-[4-[6-[3-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]-5-methyl-2,6-dioxo-pyrimidin-1-yl]hexyl]piperazin-1-yl]ethyl]thiourea ...
MW:     650.630700 g/mol MF: C28H40BrN7O4S
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-[4-[6-[3-[(2R,5S)-5-(hydroxymet...
Create Date: 2005-08-01
CID: 3005924

6343. AC1MHJM6; Heterodimer [d4T]N^3-(CH2)4-N-piperazinly[trovirdine analogue]; 1-(5-bromo-2-pyridyl)-3-[2-[4-[4-[3-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]-5-methyl-2,6-dioxo-pyrimidin-1-yl]butyl]piperazin-1-yl]ethyl]thiourea ...
MW:     622.577540 g/mol MF: C26H36BrN7O4S
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-[4-[4-[3-[(2R,5S)-5-(hydroxymet...
Create Date: 2005-08-01
CID: 3005923

6344. AC1MHJM3; Heterodimer [d4T]N^3-(CH2)3-N-piperazinyl[trovirdine analogue]; 1-(5-bromo-2-pyridyl)-3-[2-[4-[3-[3-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]-5-methyl-2,6-dioxo-pyrimidin-1-yl]propyl]piperazin-1-yl]ethyl]thiourea ...
MW:     608.550960 g/mol MF: C25H34BrN7O4S
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-[4-[3-[3-[(2R,5S)-5-(hydroxymet...
Create Date: 2005-08-01
CID: 3005922

6345. AC1MHJLU; Heterodimer [D4U]N^3-(CH2)6-N-piperazinyl[trovirdine analogue]; 1-(5-bromo-2-pyridyl)-3-[2-[4-[6-[3-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]-2,6-dioxo-pyrimidin-1-yl]hexyl]piperazin-1-yl]ethyl]thiourea ...
MW:     636.604120 g/mol MF: C27H38BrN7O4S
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-[4-[6-[3-[(2R,5S)-5-(hydroxymet...
Create Date: 2005-08-01
CID: 3005918

6346. AC1MHJLR; Heterodimer [d4U]N^3-(CH2)4-N-piperazinzyl[trovirdine analogue]; 1-(5-bromo-2-pyridyl)-3-[2-[4-[4-[3-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]-2,6-dioxo-pyrimidin-1-yl]butyl]piperazin-1-yl]ethyl]thiourea ...
MW:     608.550960 g/mol MF: C25H34BrN7O4S
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-[4-[4-[3-[(2R,5S)-5-(hydroxymet...
Create Date: 2005-08-01
CID: 3005917

6347. AC1MHJLO; Heterodimer [d4U]N^3-(CH2)3-N-piperazinyl[trovirdine analogue]; 1-(5-bromo-2-pyridyl)-3-[2-[4-[3-[3-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]-2,6-dioxo-pyrimidin-1-yl]propyl]piperazin-1-yl]ethyl]thiourea ...
MW:     594.524380 g/mol MF: C24H32BrN7O4S
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-[4-[3-[3-[(2R,5S)-5-(hydroxymet...
Create Date: 2005-08-01
CID: 3005916

6348. 1-(2-(4-imino-5-methyl(3,5-oxazolidinyl))ethyl)-5-methyl-3H-1,3-diazine-2,4-dione; 2,4(1H,3H)-Pyrimidinedione, 1-[2-(2-imino-3-methyl-4-oxazolidinyl)ethyl]-5-methyl-, (R)-; 131652-76-1 ...
MW:     252.269740 g/mol MF: C11H16N4O3
IUPAC name: 1-[2-[(4R)-2-imino-3-methyl-1,3-oxazolidin-4-yl]ethyl]-5-met...
Create Date: 2005-08-01
CID: 452444

6349. U-51605; CTK8G3687
MW:     332.480280 g/mol MF: C20H32N2O2
IUPAC name: 7-[(5R,6R)-5-oct-1-enyl-2,3-diazabicyclo[2.2.1]hept-2-en-6-y...
Create Date: 2012-07-12
CID: 57369795

6350. U-51605
MW:     332.480280 g/mol MF: C20H32N2O2
IUPAC name: 7-(5-oct-1-enyl-2,3-diazabicyclo[2.2.1]hept-2-en-6-yl)hept-5...
Create Date: 2011-10-30
CID: 53394200

6351. 52868-62-9; alpha-hydroxymethionine; 2-Hydroxy-L-methionine ...
MW:     165.210740 g/mol MF: C5H11NO3S
IUPAC name: (2R)-2-amino-2-hydroxy-4-methylsulfanylbutanoic acid
Create Date: 2010-03-30
CID: 45082566

6352. U-51605; CHEMBL482880; SRIZDZJPKIYUPZ-ACGFIOGVSA-N ...
MW:     332.480280 g/mol MF: C20H32N2O2
IUPAC name: (Z)-7-[(5R,6R)-5-[(E)-oct-1-enyl]-2,3-diazabicyclo[2.2.1]hep...
Create Date: 2010-01-26
CID: 44585558

6353. CHEMBL114733; 135423-84-6; BDBM50008293 ...
MW:     477.472620 g/mol MF: C23H23N7O5
IUPAC name: 2-[[4-[(2,4-diaminopyrido[2,3-d]pyrimidin-6-yl)methyl-prop-2...
Create Date: 2009-11-19
CID: 44341584

6354. Fluasterone; 112859-71-9; CTK8E9201 ...
MW:     290.415483 g/mol MF: C19H27FO
IUPAC name: 16-fluoro-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodeca...
Create Date: 2007-12-05
CID: 21906940

6355. 2-hydroxy-4-methylthiobutyrate; 4-methylthio-2-hydroxybutyrate; 2-hydroxy-4-methylthiobutanoate ...
MW:     149.188160 g/mol MF: C5H9O3S-
IUPAC name: 2-hydroxy-4-methylsulfanylbutanoate
Create Date: 2007-12-05
CID: 21262170

6356. 4-Diphenylcarbamyl-N-methylpiperidine; CTK8G6248; ZINC96341931 ...
MW:     294.390780 g/mol MF: C19H22N2O
IUPAC name: 1-methyl-N,N-diphenylpiperidine-4-carboxamide
Create Date: 2007-12-05
CID: 21126360

6357. U-51605
MW:     332.480280 g/mol MF: C20H32N2O2
IUPAC name: (Z)-7-[(1R,4S,6R)-5-[(E)-oct-1-enyl]-2,3-diazabicyclo[2.2.1]...
Create Date: 2007-02-28
CID: 15942747

6358. 50913-82-1; [Met(O2)4, D-Lys8, Phe9]-ADRENOCORTICOTROPIC HORMONE, Fragment 4-9; 4-[(1-{[1-({5-amino-1-[(1-carboxy-2-phenylethyl)carbamoyl]pentyl}carbamoyl)-2-phenylethyl]carbamoyl}-2-(1H-imidazol-4-yl)ethyl)carbamoyl]-4-(2-amino-4-methanesulfonylbutanamido)butanoic acid ...
MW:     869.983400 g/mol MF: C40H55N9O11S
IUPAC name: 5-[[1-[[1-[[6-amino-1-[(1-carboxy-2-phenylethyl)amino]-1-oxo...
Create Date: 2007-02-09
CID: 14345322

6359. Org-2766; AC1OCEIT; 50913-82-1 ...
MW:     869.983400 g/mol MF: C40H55N9O11S
IUPAC name: (4S)-5-[[(2S)-1-[[(2S)-1-[[(2R)-6-amino-1-[[(1S)-1-carboxy-2...
Create Date: 2006-07-28
CID: 6917685

6360. Casokefamide; 98815-38-4; UNII-B453T1E8MP ...
MW:     632.706700 g/mol MF: C33H40N6O7
IUPAC name: (2S)-2-amino-N-[(2R)-1-[[(2S)-1-[[(2R)-1-[[(2S)-1-amino-3-(4...
Create Date: 2005-08-08
CID: 5464104

6361. CHEMBL10465; AC1L7HPG; 1-(5-Benzoylamino-4-oxo-6-phenyl-hexanoyl)-pyrrolidine-2-carboxylic acid ...
MW:     422.473640 g/mol MF: C24H26N2O5
IUPAC name: 1-(5-benzamido-4-oxo-6-phenylhexanoyl)pyrrolidine-2-carboxyl...
Create Date: 2005-03-26
CID: 335542

6362. RMI 11567 DA; EINECS 252-869-2; 2,8-Bis(2-(dimethylamino)acetyl)dibenzofuran dihydrochloride ...
MW:     411.322160 g/mol MF: C20H24Cl2N2O3
IUPAC name: 2-(dimethylamino)-1-[8-[2-(dimethylamino)acetyl]dibenzofuran...
Create Date: 2005-08-08
CID: 160260

6363. Diazoketone methotrexate; HE393876
MW:     478.463980 g/mol MF: C21H22N10O4
IUPAC name: (5S)-5-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]ben...
Create Date: 2005-08-08
CID: 134133

6364. Org 2766; EINECS 256-843-1; L-Phenylalanine, gamma-(methylsulfonyl)-L-alpha-aminobutyryl-L-alpha-glutamyl-L-histidyl-L-phenylalanyl-D-lysyl- ...
MW:     869.983400 g/mol MF: C40H55N9O11S
IUPAC name: (4S)-5-[[(2S)-1-[[(2S)-1-[[(2R)-6-amino-1-[[(1S)-1-carboxy-2...
Create Date: 2005-08-08
CID: 104992

6365. ZINC72130366; N-Benzyloxycarbonyl Lisinopril Cyclohexyl Analogue Ethyl Methyl Diester; (S)-1-[N2-(1-Carboxy-3-cyclohexylpropyl)-N-benzyloxycarbonyl-L-lysyl]-L-proline Ethyl Methyl Diester
MW:     587.747360 g/mol MF: C32H49N3O7
IUPAC name: methyl (2S)-1-[(2S)-2-[[(2S)-4-cyclohexyl-1-ethoxy-1-oxobuta...
Create Date: 2013-05-17
CID: 71313859

6366. CHEMBL262992; BDBM50127519; [D-Tyr6-, Beta-Ala11, Phe13, Nle14] Bn (6-14)(Bombesin Analogue)
MW:    1106.314960 g/mol MF: C58H79N11O11
IUPAC name: (2S)-2-[[(2S)-2-[[(2S)-2-[3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S...
Create Date: 2009-11-19
CID: 44300286

6367. .Alpha.-d(5'-CCAGCTCGGGCCCTCG-3'); 5'-aC aC AA aG aC aT aC aG aG aG aC aC aC aT aC aG-3'; Alpha-anomeric parallel-binding analog of d(5'-GCTCCCGGGCTCGACC-3')
MW:    4819.112730 g/mol MF: C152H195N58O95P15
Create Date: 2007-07-03
CID: 16130301

6368. AC1O55EF; Heterodimer [d4U]N^3-CH2-CH=CH-CH2-N-piperazinyl[trovirdine analogue]; 1-(5-bromo-2-pyridyl)-3-[2-[4-[(E)-4-[3-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]-2,6-dioxo-pyrimidin-1-yl]but-2-enyl]piperazin-1-yl]ethyl]thiourea ...
MW:     606.535080 g/mol MF: C25H32BrN7O4S
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-[4-[(E)-4-[3-[(2R,5S)-5-(hydrox...
Create Date: 2006-04-29
CID: 6478078

6369. AC1MHJLX; Heterodimer [d4U]N^3-CH2-CH2-O-CH2-CH2-N-piperazinyl[trovirdine analogue; 1-(5-bromo-2-pyridyl)-3-[2-[4-[2-[2-[3-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]-2,6-dioxo-pyrimidin-1-yl]ethoxy]ethyl]piperazin-1-yl]ethyl]thiourea ...
MW:     624.550360 g/mol MF: C25H34BrN7O5S
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-[4-[2-[2-[3-[(2R,5S)-5-(hydroxy...
Create Date: 2005-08-01
CID: 3005919

6370. 131652-40-9; 2,4(1H,3H)-Pyrimidinedione, 1-(2-(2-amino-4,5-dihydro-4-oxazolyl)ethyl)-5-methyl-, (R)-; 2,4(1H,3H)-Pyrimidinedione, 1-[2-(2-amino-4,5-dihydro-4-oxazolyl)ethyl]-5-methyl-, (R)- ...
MW:     238.243160 g/mol MF: C10H14N4O3
IUPAC name: 1-[2-[(4R)-2-amino-4,5-dihydro-1,3-oxazol-4-yl]ethyl]-5-meth...
Create Date: 2005-08-01
CID: 452438

6371. 1-(3-sulfanylpropanoyl)-l-proline; CHEMBL10962; L-Proline, 1-(3-mercapto-1-oxopropyl)- ...
MW:     203.258720 g/mol MF: C8H13NO3S
IUPAC name: (2S)-1-(3-sulfanylpropanoyl)pyrrolidine-2-carboxylic acid
Create Date: 2005-08-08
CID: 99978

6372. CYTARABINE HYDROCHLORIDE; 69-74-9; SCHEMBL5961357 ...
MW:     279.677560 g/mol MF: C9H14ClN3O5
IUPAC name: 4-amino-1-[(2S,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxol...
Create Date: 2012-12-01
CID: 69621045

6373. 3-Deazuridine; 23205-42-7; EINECS 245-488-8 ...
MW:     243.213320 g/mol MF: C10H13NO6
IUPAC name: 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]...
Create Date: 2011-12-26
CID: 54684286

6374. Naritheracin; Toyokamycin; Siromycin ...
MW:     291.262720 g/mol MF: C12H13N5O4
IUPAC name: 4-amino-7-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxol...
Create Date: 2011-06-15
CID: 52940199

6375. CYTARABINE HYDROCHLORIDE; Cylocide; NSC63878 ...
MW:     279.677560 g/mol MF: C9H14ClN3O5
IUPAC name: 4-amino-1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimi...
Create Date: 2006-02-02
CID: 5351180

6376. NSC406021; .beta.-D-Arabinosyl-6-mercaptopurine; 6-Thiopurine riboside ...
MW:     284.291680 g/mol MF: C10H12N4O4S
IUPAC name: 9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purine-6-t...
Create Date: 2005-03-25
CID: 2861016

6377. 6-Thioinosine; THIOINOSINE; 6-mercaptopurine riboside ...
MW:     284.291680 g/mol MF: C10H12N4O4S
IUPAC name: 9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]...
Create Date: 2005-06-24
CID: 676166

6378. TOYOCAMYCIN; Vengicide; MLS002702992 ...
MW:     291.262720 g/mol MF: C12H13N5O4
IUPAC name: 4-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrol...
Create Date: 2005-03-26
CID: 247955

6379. 1-(arabinofuranosyl)cytosine; Arabinofuranosylcytosine; Aracytidine ...
MW:     243.216620 g/mol MF: C9H13N3O5
IUPAC name: 4-amino-1-[(3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-...
Create Date: 2005-06-01
CID: 114682

6380. TOYOCAMYCIN; Vengicide; Unamycin B ...
MW:     291.262720 g/mol MF: C12H13N5O4
IUPAC name: 4-amino-7-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxol...
Create Date: 2005-08-01
CID: 11824

6381. 5-azacytidine; Azacitidine; 320-67-2 ...
MW:     244.204680 g/mol MF: C8H12N4O5
IUPAC name: 4-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxol...
Create Date: 2004-09-16
CID: 9444

6382. cytarabine; 147-94-4; Ara-C ...
MW:     243.216620 g/mol MF: C9H13N3O5
IUPAC name: 4-amino-1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxol...
Create Date: 2005-06-24
CID: 6253

6383. CYTARABINE HYDROCHLORIDE; Cytosine arabinoside hydrochloride; Ara-C hydrochloride ...
MW:     279.677560 g/mol MF: C9H14ClN3O5
IUPAC name: 4-amino-1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxol...
Create Date: 2005-07-19
CID: 6252

6384. 5-Fluorouracil; fluorouracil; 51-21-8 ...
MW:     130.077223 g/mol MF: C4H3FN2O2
IUPAC name: 5-fluoro-1H-pyrimidine-2,4-dione
Create Date: 2005-03-25
CID: 3385

6385. .beta.-Arabinosylcytosine; .beta.-Cytosine arabinoside; .beta.-D-Arabinosylcytosine ...
MW:     243.216620 g/mol MF: C9H13N3O5
IUPAC name: 4-amino-1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimi...
Create Date: 2005-03-25
CID: 596

6386. Puromycin dihydrochloride; 58-58-2; P2311
MW:     544.431440 g/mol MF: C22H31Cl2N7O5
IUPAC name: (2S)-2-amino-N-[5-[6-(dimethylamino)purin-9-yl]-4-hydroxy-2-...
Create Date: 2015-11-02
CID: 91972130

6387. Stillomycin; Stylomycin; Achromycin (purine derivative) ...
MW:     471.509560 g/mol MF: C22H29N7O5
IUPAC name: 2-amino-N-[(2R,3S,4S,5S)-5-[6-(dimethylamino)purin-9-yl]-4-h...
Create Date: 2015-04-28
CID: 91711144

6388. FTK8U1GZNX; UNII-FTK8U1GZNX; Thioguanine hydrate ...
MW:     352.398680 g/mol MF: C10H12N10OS2
IUPAC name: 2-amino-3,7-dihydropurine-6-thione;hydrate
Create Date: 2015-04-25
CID: 91669166

6389. INCB024360; 914471-09-3; UNII-2HR315841W ...
MW:     271.635583 g/mol MF: C9H7ClFN5O2
IUPAC name: (4Z)-4-[(3-chloro-4-fluoroanilino)-nitrosomethylidene]-1,2,5...
Create Date: 2014-08-06
CID: 76844477

6390. alpha-Desphenyl-alpha-cyclohexenyl oxybutynin; Oxybutynin hydrochloride specified impurity A [EP]; 4-(Diethylamino)but-2-ynyl (+/-)-2-(cyclohex-3-enyl)-2-cyclohexyl-2-hydroxyacetate ...
MW:     361.518200 g/mol MF: C22H35NO3
IUPAC name: 4-(diethylamino)but-2-ynyl 2-cyclohex-3-en-1-yl-2-cyclohexyl...
Create Date: 2014-03-02
CID: 72941994

6391. Puromycin hydrochloride; Pharmakon1600-01501105; NSC757836 ...
MW:     507.970500 g/mol MF: C22H30ClN7O5
IUPAC name: (2S)-2-amino-N-[(2S,3S,4R)-5-[6-(dimethylamino)purin-9-yl]-4...
Create Date: 2012-08-31
CID: 60148403

6392. Teysuno; Gimeracil / oteracil / tegafur; Tegafur-gimeracil-oteracil potassium ...
MW:     540.885503 g/mol MF: C17H15ClFKN6O9
IUPAC name: potassium;5-chloro-4-hydroxy-1H-pyridin-2-one;4,6-dioxo-1H-1...
Create Date: 2011-12-26
CID: 54715158

6393. 3-[1-(4-bromo-phenyl)-2-methyl-propyl]-4-hydroxy-chromen-2-one; U01; AC1L9MI1 ...
MW:     373.240480 g/mol MF: C19H17BrO3
IUPAC name: 3-[(1S)-1-(4-bromophenyl)-2-methylpropyl]-4-hydroxychromen-2...
Create Date: 2011-12-26
CID: 54693872

6394. 5,10-dideazatetrahydrofolic acid; ZINC4658141; DB03625 ...
MW:     443.453100 g/mol MF: C21H25N5O6
IUPAC name: (2R)-2-[[4-[2-[(6S)-2-amino-4-oxo-5,6,7,8-tetrahydro-1H-pyri...
Create Date: 2010-11-09
CID: 46936736

6395. N-(Phosphonacetyl)-L-Aspartate
MW:     252.095442 g/mol MF: C6H7NO8P-3
IUPAC name: (2S)-2-[[2-[hydroxy(oxido)phosphoryl]acetyl]amino]butanedioa...
Create Date: 2010-10-25
CID: 46926274

6396. TMTX; CI 898; CI 898 dihydrochloride ...
MW:     442.339500 g/mol MF: C19H25Cl2N5O3
IUPAC name: 5-methyl-6-[(3,4,5-trimethoxyanilino)methyl]quinazoline-2,4-...
Create Date: 2010-09-02
CID: 46861541

6397. CHEMBL438421; BDBM50120208; R1-Lys-Gln-Ile-Ile-Asn-Met-Trp-Gln-Glu-Val-Gly-Covalently reactive antigenic peptide analog (CRA)
MW:    2169.550142 g/mol MF: C98H142N23O23PS4
Create Date: 2009-11-19
CID: 44337718

6398. Sodium (S)-4-carboxy-2-(4-(((2,4-diaminopteridin-6-yl)methyl)(methyl)amino)benzamido)butanoate; 7532-04-9; METHOTREXATE SODIUM ...
MW:     476.421109 g/mol MF: C20H21N8NaO5
IUPAC name: sodium;(2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylam...
Create Date: 2008-09-30
CID: 24906323

6399. PHENYLACETIC ACID, SODIUM SALT; sodium 2-phenylacetic acid; sodium 2-phenylethanoic acid ...
MW:     159.137689 g/mol MF: C8H8NaO2+
IUPAC name: sodium;2-phenylacetic acid
Create Date: 2008-02-29
CID: 24180949

6400. sodium phenylacetate; 114-70-5; sodium 2-phenylacetate ...
MW:     158.129749 g/mol MF: C8H7NaO2
IUPAC name: sodium;2-phenylacetate
Create Date: 2008-02-05
CID: 23690424

6401. METHOTREXATE SODIUM; MTX sodium; 59-05-2 (Parent) ...
MW:     476.421109 g/mol MF: C20H21N8NaO5
IUPAC name: sodium;(4S)-4-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylam...
Create Date: 2008-02-05
CID: 23678981

6402. ANCITABINE HYDROCHLORIDE; 2,2'-Anhydrocytidine hydrochloride; O2, monohydrochloride ...
MW:     261.662280 g/mol MF: C9H12ClN3O4
IUPAC name: 2-(hydroxymethyl)-6-imino-2,3,3a,9a-tetrahydrofuro[1,2][1,3]...
Create Date: 2007-11-09
CID: 16757841

6403. Puromycin dihydrochloride; NCGC00094893-01; 58-58-2 ...
MW:     544.431440 g/mol MF: C22H31Cl2N7O5
IUPAC name: 2-amino-N-[5-[6-(dimethylamino)purin-9-yl]-4-hydroxy-2-(hydr...
Create Date: 2007-11-09
CID: 16757772

6404. Puromycin aminonucleoside; P7130_SIGMA; 58-60-6 ...
MW:     294.309720 g/mol MF: C12H18N6O3
IUPAC name: (2R,3S,4R,5S)-4-amino-2-[6-(dimethylamino)purin-9-yl]-5-(hyd...
Create Date: 2007-07-16
CID: 16219893

6405. 5'-deoxy-5'-fluorouridine; SCHEMBL346519; CHEMBL336637 ...
MW:     246.192443 g/mol MF: C9H11FN2O5
IUPAC name: 1-[(2R,3R,4S,5S)-5-(fluoromethyl)-3,4-dihydroxyoxolan-2-yl]p...
Create Date: 2007-02-09
CID: 14608008

6406. Puromycin dihydrochloride; C11618; D05655 ...
MW:     544.431440 g/mol MF: C22H31Cl2N7O5
IUPAC name: (2S)-2-amino-N-[(2S,4R,5R)-5-[6-(dimethylamino)purin-9-yl]-4...
Create Date: 2006-11-22
CID: 11953958

6407. UNII-6U3LPL9PRN; decitabine mesylate; 6U3LPL9PRN ...
MW:     324.310940 g/mol MF: C9H16N4O7S
IUPAC name: 4-amino-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl...
Create Date: 2006-10-26
CID: 11631196

6408. Azathioprine sodium; UNII-AM94R510MS; AM94R510MS ...
MW:     299.244409 g/mol MF: C9H6N7NaO2S
IUPAC name: sodium;6-(3-methyl-5-nitroimidazol-4-yl)sulfanylpurin-9-ide
Create Date: 2006-10-26
CID: 11529527

6409. Sodium methotrexate; 7413-34-5; METHOTREXATE SODIUM ...
MW:     498.402939 g/mol MF: C20H20N8Na2O5
IUPAC name: disodium;(2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methyl...
Create Date: 2006-10-26
CID: 11329481

6410. 6-diazo-5-oxo-L-norleucine; MFCD00037218; (S)-2-Amino-6-diazo-5-oxocaproic acid ...
MW:     171.153960 g/mol MF: C6H9N3O3
IUPAC name: (E,5S)-5-amino-1-diazonio-6-hydroxy-6-oxohex-1-en-2-olate
Create Date: 2006-07-28
CID: 6918327

6411. Puromycin dihydrochloride; Prestwick_627; AC1O4WHJ ...
MW:     544.431440 g/mol MF: C22H31Cl2N7O5
IUPAC name: 2-amino-N-[(2S,3R,5R)-5-[6-(dimethylamino)purin-9-yl]-4-hydr...
Create Date: 2006-04-14
CID: 6419988

6412. Puromycin hydrochloride; AC1NWAST; Spectrum2_000896 ...
MW:     471.509560 g/mol MF: C22H29N7O5
IUPAC name: (2S)-2-amino-N-[(2S,3S,4R)-5-[6-(dimethylamino)purin-9-yl]-4...
Create Date: 2006-03-07
CID: 5702164

6413. Puromycin hydrochloride; AC1NWASQ; SPECTRUM1501105 ...
MW:     544.431440 g/mol MF: C22H31Cl2N7O5
IUPAC name: (2S)-2-amino-N-[(2S,3S,4R)-5-[6-(dimethylamino)purin-9-yl]-4...
Create Date: 2006-03-07
CID: 5702163

6414. 6-diazo-5-oxo-L-norleucine; DON (pharmaceutical); L-DON ...
MW:     171.153960 g/mol MF: C6H9N3O3
IUPAC name: (Z,5S)-5-amino-1-diazonio-6-hydroxy-6-oxohex-1-en-2-olate
Create Date: 2005-08-01
CID: 5359375

6415. NSC3055; Puromycin hydrochloride; Purine, dihydrochloride ...
MW:     507.970500 g/mol MF: C22H30ClN7O5
IUPAC name: (2S)-2-amino-N-[5-[6-(dimethylamino)purin-9-yl]-4-hydroxy-2-...
Create Date: 2006-02-02
CID: 5351454

6416. NSC264880; DHAC; Dihydro-5-azacytidine ...
MW:     282.681500 g/mol MF: C8H15ClN4O5
IUPAC name: 6-amino-3-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,4-d...
Create Date: 2006-02-02
CID: 5351280

6417. Norleucine, 6-diazo-5-oxo-; 6-Diazo-5-oxo-norleucine; 6-diazo-5-oxo-L-norleucine ...
MW:     171.153960 g/mol MF: C6H9N3O3
IUPAC name: (Z)-5-amino-1-diazonio-6-hydroxy-6-oxohex-1-en-2-olate
Create Date: 2005-06-23
CID: 5351132

6418. azaserine; Azaserin; O-Diazoacetyl-L-serine ...
MW:     173.126780 g/mol MF: C5H7N3O4
IUPAC name: (E)-1-[(2S)-2-amino-2-carboxyethoxy]-2-diazonioethenolate
Create Date: 2005-06-01
CID: 5284344

6419. phenylacetate; 2-phenylacetate; 2-phenylethanoate ...
MW:     135.139980 g/mol MF: C8H7O2-
IUPAC name: 2-phenylacetate
Create Date: 2004-09-16
CID: 4409936

6420. THIOURIDINE; Uridine, 4-thio-; zlchem 1221 ...
MW:     260.266980 g/mol MF: C9H12N2O5S
IUPAC name: 1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-sulfanylide...
Create Date: 2005-03-26
CID: 3954028

6421. MLS000738229; 6-Mercaptoguanosine; 2-Amino-6-mercaptopurine riboside ...
MW:     299.306320 g/mol MF: C10H13N5O4S
IUPAC name: 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-pu...
Create Date: 2005-03-26
CID: 3938248

6422. 2-Chloro-3'-deoxyadenosine; UNII-JYW18Y92UP; 3'-Deoxy-2-chloroadenosine ...
MW:     285.686980 g/mol MF: C10H12ClN5O3
IUPAC name: (2R,3R,5S)-2-(6-amino-2-chloropurin-9-yl)-5-(hydroxymethyl)o...
Create Date: 2005-08-08
CID: 3034808

6423. 4-Thiouridine; 13957-31-8; THIOURIDINE ...
MW:     260.266980 g/mol MF: C9H12N2O5S
IUPAC name: 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]...
Create Date: 2005-08-08
CID: 3032615

6424. AC1MHJMC; Heterodimer [d4T]N^3-CH2-CH2-O-CH2-CH2-N-piperazinyl[trovirdine analogue]; 1-(5-bromo-2-pyridyl)-3-[2-[4-[2-[2-[3-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]-5-methyl-2,6-dioxo-pyrimidin-1-yl]ethoxy]ethyl]piperazin-1-yl]ethyl]thiourea ...
MW:     638.576940 g/mol MF: C26H36BrN7O5S
IUPAC name: 1-(5-bromopyridin-2-yl)-3-[2-[4-[2-[2-[3-[(2R,5S)-5-(hydroxy...
Create Date: 2005-08-01
CID: 3005925

6425. 6-Thioguanosine; 85-31-4; THIOGUANOSINE ...
MW:     299.306320 g/mol MF: C10H13N5O4S
IUPAC name: 2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxol...
Create Date: 2005-07-19
CID: 2724387

6426. 6112-76-1; UNII-E7WED276I5; C5H4N4S.H2O ...
MW:     170.192340 g/mol MF: C5H6N4OS
IUPAC name: 3,7-dihydropurine-6-thione;hydrate
Create Date: 2005-06-24
CID: 2724350

6427. 6-Thioguanine; thioguanine; Tioguanine ...
MW:     167.191700 g/mol MF: C5H5N5S
IUPAC name: 2-amino-3,7-dihydropurine-6-thione
Create Date: 2005-03-25
CID: 2723601

6428. 6-Mercaptopurine; mercaptopurine; 50-44-2 ...
MW:     152.177060 g/mol MF: C5H4N4S
IUPAC name: 3,7-dihydropurine-6-thione
Create Date: 2004-09-16
CID: 667490

6429. FdUrd; 5-FUDR; 5-Fluorouracil deoxyriboside ...
MW:     246.192443 g/mol MF: C9H11FN2O5
IUPAC name: 5-fluoro-1-[(4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]p...
Create Date: 2005-06-01
CID: 643968

6430. azaserine; L-Serine, diazoacetate (ester); 115-02-6 ...
MW:     173.126780 g/mol MF: C5H7N3O4
IUPAC name: 1-[(2S)-2-amino-2-carboxyethoxy]-2-diazonioethenolate
Create Date: 2005-06-01
CID: 460129

6431. TIAZOFURIN; Tiazofurine; Riboxamide ...
MW:     260.266980 g/mol MF: C9H12N2O5S
IUPAC name: 2-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]...
Create Date: 2005-08-01
CID: 457954

6432. Benzoyl-Mesyl-FMAU; 132776-18-2; 2,4(1H,3H)-Pyrimidinedione, 1-(5-O-benzoyl-2-deoxy-2-fluoro-3-O-(methylsulfonyl)-b-D-arabinofuranosyl)-5-methyl- ...
MW:     442.415463 g/mol MF: C18H19FN2O8S
IUPAC name: [(2R,3R,4S,5R)-4-fluoro-5-(5-methyl-2,4-dioxopyrimidin-1-yl)...
Create Date: 2005-08-01
CID: 453022

6433. Decitabine; 5-Aza-2'-deoxycytidine; 2353-33-5 ...
MW:     228.205280 g/mol MF: C8H12N4O4
IUPAC name: 4-amino-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl...
Create Date: 2005-08-01
CID: 451668

6434. Puromycin dihydrochloride; Puromycin HCl; 58-58-2 ...
MW:     544.431440 g/mol MF: C22H31Cl2N7O5
IUPAC name: (2S)-2-amino-N-[(2S,3S,4R,5R)-5-[6-(dimethylamino)purin-9-yl...
Create Date: 2005-06-24
CID: 443311

6435. puromycin; Stylomycin; Puromycinum ...
MW:     471.509560 g/mol MF: C22H29N7O5
IUPAC name: (2S)-2-amino-N-[(2S,3S,4R,5R)-5-[6-(dimethylamino)purin-9-yl...
Create Date: 2004-09-16
CID: 439530

6436. JB-11 isethionate; Trimetrexate isethionate salt; NSC 328564 ...
MW:     495.549260 g/mol MF: C21H29N5O7S
IUPAC name: 2-hydroxyethanesulfonic acid;5-methyl-6-[(3,4,5-trimethoxyan...
Create Date: 2005-03-26
CID: 332299

6437. acivicin; 42228-92-2; AT-125 ...
MW:     178.573680 g/mol MF: C5H7ClN2O3
IUPAC name: (2S)-2-amino-2-[(5S)-3-chloro-4,5-dihydro-1,2-oxazol-5-yl]ac...
Create Date: 2005-03-26
CID: 294641

6438. Pyrozofurin; Pirazofurin; Pyrazomycin ...
MW:     259.216020 g/mol MF: C9H13N3O6
IUPAC name: 5-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-hydroxy-1H-...
Create Date: 2005-03-26
CID: 285701

6439. MLS000766237; O2,2'-Cyclocytidine monoacetate; Cyclo-C ...
MW:     285.253300 g/mol MF: C11H15N3O6
IUPAC name: acetic acid;2-(hydroxymethyl)-6-imino-2,3,3a,9a-tetrahydrofu...
Create Date: 2005-03-26
CID: 279062

6440. Uridine, 5-bromo-2'-deoxy-; Bromoouridine; Radibud ...
MW:     307.098040 g/mol MF: C9H11BrN2O5
IUPAC name: 5-bromo-1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine...
Create Date: 2005-03-26
CID: 236184

6441. UNII-TA5S1BS78J; TA5S1BS78J; 5,6-Dihydro-5-azacytidine hydrochloride ...
MW:     282.681500 g/mol MF: C8H15ClN4O5
IUPAC name: 6-amino-3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxol...
Create Date: 2005-08-08
CID: 151716

6442. Lometrexol; UNII-6P3AVY8A7Q; 106400-81-1 ...
MW:     443.453100 g/mol MF: C21H25N5O6
IUPAC name: (2S)-2-[[4-[2-[(6R)-2-amino-4-oxo-5,6,7,8-tetrahydro-1H-pyri...
Create Date: 2005-06-24
CID: 148138

6443. methotrexate; 59-05-2; Rheumatrex ...
MW:     454.439280 g/mol MF: C20H22N8O5
IUPAC name: (2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]ben...
Create Date: 2005-06-24
CID: 126941

6444. Clofarabine; 123318-82-1; Clolar ...
MW:     303.677443 g/mol MF: C10H11ClFN5O3
IUPAC name: (2R,3R,4S,5R)-5-(6-amino-2-chloropurin-9-yl)-4-fluoro-2-(hyd...
Create Date: 2005-08-08
CID: 119182

6445. Nolatrexed; 147149-76-6; UNII-K75ZUN743Q ...
MW:     284.336280 g/mol MF: C14H12N4OS
IUPAC name: 2-amino-6-methyl-5-pyridin-4-ylsulfanyl-1H-quinazolin-4-one
Create Date: 2005-03-26
CID: 108189

6446. Nolatrexed dihydrochloride; 152946-68-4; Thymitaq ...
MW:     357.258160 g/mol MF: C14H14Cl2N4OS
IUPAC name: 2-amino-6-methyl-5-pyridin-4-ylsulfanyl-1H-quinazolin-4-one;...
Create Date: 2005-08-08
CID: 108188

6447. Lometrexol; DATHF; DDATHF ...
MW:     443.453100 g/mol MF: C21H25N5O6
IUPAC name: (2S)-2-[[4-[2-(2-amino-4-oxo-5,6,7,8-tetrahydro-1H-pyrido[2,...
Create Date: 2005-08-08
CID: 105040

6448. Raltitrexed; Tomudex; 112887-68-0 ...
MW:     458.487580 g/mol MF: C21H22N4O6S
IUPAC name: (2S)-2-[[5-[methyl-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methy...
Create Date: 2005-06-24
CID: 104758

6449. Tegafur-Uracil; Ufur; Youfuding ...
MW:     312.253823 g/mol MF: C12H13FN4O5
IUPAC name: 5-fluoro-1-(oxolan-2-yl)pyrimidine-2,4-dione;1H-pyrimidine-2...
Create Date: 2005-06-24
CID: 104747

6450. 5,6-Dihydro-5-azacytidine; 62488-57-7; UNII-0627D8VG1C ...
MW:     246.220560 g/mol MF: C8H14N4O5
IUPAC name: 6-amino-3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxol...
Create Date: 2005-08-01
CID: 99681

6451. 9-Hydroxyellipticine; 9-Hydroxyellipticin; Hydroxyellipticine ...
MW:     262.305860 g/mol MF: C17H14N2O
IUPAC name: 5,11-dimethyl-6H-pyrido[4,3-b]carbazol-9-ol
Create Date: 2005-03-26
CID: 91643

6452. 5-Thio-D-Glucose; 20408-97-3; D-Glucose, 5-thio- ...
MW:     196.221480 g/mol MF: C6H12O5S
IUPAC name: (2R,3R,4S,5R)-2,3,4,6-tetrahydroxy-5-sulfanylhexanal
Create Date: 2005-08-08
CID: 88527

6453. CAPECITABINE; 154361-50-9; Xeloda ...
MW:     359.350083 g/mol MF: C15H22FN3O6
IUPAC name: pentyl N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methyloxolan-2-yl...
Create Date: 2005-06-24
CID: 60953

6454. gemcitabine; 95058-81-4; 2',2'-Difluorodeoxycytidine ...
MW:     263.198146 g/mol MF: C9H11F2N3O4
IUPAC name: 4-amino-1-[(2R,4R,5R)-3,3-difluoro-4-hydroxy-5-(hydroxymethy...
Create Date: 2005-06-24
CID: 60750

6455. GEMCITABINE HYDROCHLORIDE; Gemzar; Gemcitabine HCl ...
MW:     299.659086 g/mol MF: C9H12ClF2N3O4
IUPAC name: 4-amino-1-[(2R,4R,5R)-3,3-difluoro-4-hydroxy-5-(hydroxymethy...
Create Date: 2005-06-24
CID: 60749

6456. Dezaguanine; 3-Deazaguanine; 41729-52-6 ...
MW:     150.138040 g/mol MF: C6H6N4O
IUPAC name: 6-amino-1,5-dihydroimidazo[4,5-c]pyridin-4-one
Create Date: 2005-03-26
CID: 55710

6457. Sparfosate tetrasodium; NSC 224131; AC1L29HC ...
MW:     343.046579 g/mol MF: C6H6NNa4O8P
IUPAC name: tetrasodium;(2S)-2-[(2-phosphonatoacetyl)amino]butanedioate
Create Date: 2005-08-08
CID: 43252

6458. Sparfosic acid; PALA; NSC-224131 ...
MW:     255.119262 g/mol MF: C6H10NO8P
IUPAC name: (2S)-2-[(2-phosphonoacetyl)amino]butanedioic acid
Create Date: 2005-06-24
CID: 39981

6459. Pyrazofurin; Pirazofurin; Pyrazomycin ...
MW:     259.216020 g/mol MF: C9H13N3O6
IUPAC name: 5-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]...
Create Date: 2005-08-01
CID: 35595

6460. Vidarabine monophosphate; 29984-33-6; Ara-AMP ...
MW:     347.221222 g/mol MF: C10H14N5O7P
IUPAC name: [(2R,3S,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-y...
Create Date: 2005-07-12
CID: 34768

6461. fludarabine phosphate; 75607-67-9; fludara ...
MW:     365.211685 g/mol MF: C10H13FN5O7P
IUPAC name: [(2R,3S,4S,5R)-5-(6-amino-2-fluoropurin-9-yl)-3,4-dihydroxyo...
Create Date: 2005-06-24
CID: 30751

6462. ANCITABINE; Cyclocytidine; 2,2'-Cyclocytidine ...
MW:     225.201340 g/mol MF: C9H11N3O4
IUPAC name: (2R,3R,3aS,9aR)-2-(hydroxymethyl)-6-imino-2,3,3a,9a-tetrahyd...
Create Date: 2005-06-24
CID: 25051

6463. Cyclocytidine hydrochloride; Cyclocytidine; 10212-25-6 ...
MW:     261.662280 g/mol MF: C9H12ClN3O4
IUPAC name: (2R,3R,3aS,9aR)-2-(hydroxymethyl)-6-imino-2,3,3a,9a-tetrahyd...
Create Date: 2005-06-24
CID: 25050

6464. BUTHIONINE SULFOXIMINE; 5072-26-4; DL-Buthionine-[S,R]-sulfoximine ...
MW:     222.305120 g/mol MF: C8H18N2O3S
IUPAC name: 2-amino-4-(butylsulfonimidoyl)butanoic acid
Create Date: 2005-03-26
CID: 21157

6465. doxifluridine; 5'-Deoxy-5-fluorouridine; 5-fluoro-5'-deoxyuridine ...
MW:     246.192443 g/mol MF: C9H11FN2O5
IUPAC name: 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methyloxolan-2-yl]-5-fluoro...
Create Date: 2005-06-24
CID: 18343

6466. stavudine; sanilvudine; 3056-17-5 ...
MW:     224.213280 g/mol MF: C10H12N2O4
IUPAC name: 1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]-5-methyl...
Create Date: 2005-06-24
CID: 18283

6467. Dacogen; C8H12N4O4; NSC-127716 ...
MW:     228.205280 g/mol MF: C8H12N4O4
IUPAC name: 4-amino-1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,3,5-tri...
Create Date: 2005-03-26
CID: 16886

6468. 6-diazo-5-oxo-L-norleucine; 157-03-9; L-Norleucine,6-diazo-5-oxo- ...
MW:     171.153960 g/mol MF: C6H9N3O3
IUPAC name: (5S)-5-amino-1-diazonio-6-hydroxy-6-oxohex-1-en-2-olate
Create Date: 2005-08-01
CID: 9087

6469. 8-AZAGUANINE; Guanazolo; 134-58-7 ...
MW:     152.114160 g/mol MF: C4H4N6O
IUPAC name: 5-amino-2,3-dihydrotriazolo[4,5-d]pyrimidin-7-one
Create Date: 2005-03-27
CID: 8646

6470. tubercidin; 7-Deazaadenosine; Sparsomycin A ...
MW:     266.253260 g/mol MF: C11H14N4O4
IUPAC name: (2R,3R,4S,5R)-2-(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(hyd...
Create Date: 2005-06-24
CID: 6245

6471. 5-BROMO-2'-DEOXYURIDINE; 59-14-3; Broxuridine ...
MW:     307.098040 g/mol MF: C9H11BrN2O5
IUPAC name: 5-bromo-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl...
Create Date: 2005-06-24
CID: 6035

6472. Puromycin aminonucleoside; Aminonucleoside; Stylomycin aminonucleoside ...
MW:     294.309720 g/mol MF: C12H18N6O3
IUPAC name: (2R,3R,4S,5S)-4-amino-2-[6-(dimethylamino)purin-9-yl]-5-(hyd...
Create Date: 2005-06-24
CID: 6020

6473. 6-AZAURIDINE; 6-Azuridine; Azauridine ...
MW:     245.189440 g/mol MF: C8H11N3O6
IUPAC name: 2-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]...
Create Date: 2005-07-10
CID: 5901

6474. floxuridine; 50-91-9; 2'-Deoxy-5-fluorouridine ...
MW:     246.192443 g/mol MF: C9H11FN2O5
IUPAC name: 5-fluoro-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-y...
Create Date: 2005-06-24
CID: 5790

6475. trimetrexate; CI-898; 52128-35-5 ...
MW:     369.417620 g/mol MF: C19H23N5O3
IUPAC name: 5-methyl-6-[(3,4,5-trimethoxyanilino)methyl]quinazoline-2,4-...
Create Date: 2005-03-25
CID: 5583

6476. tegafur; Ftorafur; 17902-23-7 ...
MW:     200.167063 g/mol MF: C8H9FN2O3
IUPAC name: 5-fluoro-1-(oxolan-2-yl)pyrimidine-2,4-dione
Create Date: 2005-03-25
CID: 5386

6477. Amethopterin; Methylaminopterin; DL-Amethopterin ...
MW:     454.439280 g/mol MF: C20H22N8O5
IUPAC name: 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]...
Create Date: 2005-03-25
CID: 4112

6478. 5-Fluorocytosine; flucytosine; 2022-85-7 ...
MW:     129.092463 g/mol MF: C4H4FN3O
IUPAC name: 6-amino-5-fluoro-1H-pyrimidin-2-one
Create Date: 2005-03-25
CID: 3366

6479. FdUrd; Uridine, 2'-deoxy-5-fluoro-; 2968-28-7 ...
MW:     246.192443 g/mol MF: C9H11FN2O5
IUPAC name: 5-fluoro-1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin...
Create Date: 2005-03-25
CID: 3363

6480. azathioprine; 446-86-6; Imuran ...
MW:     277.262580 g/mol MF: C9H7N7O2S
IUPAC name: 6-(3-methyl-5-nitroimidazol-4-yl)sulfanyl-7H-purine
Create Date: 2005-03-25
CID: 2265

6481. amino(3-chloro-4,5-dihydro-1,2-oxazol-5-yl)acetic acid; 52583-41-2; alpha-Amino-3-chloro-4,5-dihydro-5-isoxazoleacetic acid ...
MW:     178.573680 g/mol MF: C5H7ClN2O3
IUPAC name: 2-amino-2-(3-chloro-4,5-dihydro-1,2-oxazol-5-yl)acetic acid
Create Date: 2005-03-25
CID: 2007

6482. Lometrexol; CHEMBL170101; AC1L1C7F ...
MW:     443.453100 g/mol MF: C21H25N5O6
IUPAC name: 2-[[4-[2-(2-amino-4-oxo-5,6,7,8-tetrahydro-1H-pyrido[2,3-d]p...
Create Date: 2005-03-25
CID: 1773

6483. Puromycin aminonucleoside; NSC3056; ARDMA ...
MW:     294.309720 g/mol MF: C12H18N6O3
IUPAC name: 4-amino-2-[6-(dimethylamino)purin-9-yl]-5-(hydroxymethyl)oxo...
Create Date: 2005-03-25
CID: 1599

6484. PHENYLACETIC ACID; Benzeneacetic acid; 2-Phenylacetic acid ...
MW:     136.147920 g/mol MF: C8H8O2
IUPAC name: 2-phenylacetic acid
Create Date: 2004-09-16
CID: 999

6485. 6-diazo-5-oxo-L-norleucine; Norleucine,6-diazo-5-oxo-; 157-03-9 ...
MW:     171.153960 g/mol MF: C6H9N3O3
IUPAC name: 5-amino-1-diazonio-6-hydroxy-6-oxohex-1-en-2-olate
Create Date: 2005-06-23
CID: 164

6486. OXYTETRACYCLINE HYDROCHLORIDE; 2058-46-0; MFCD00135815
MW:     496.894900 g/mol MF: C22H25ClN2O9
IUPAC name: (4S,4aR,5S,5aR,6S,12aS)-4-(dimethylamino)-3,5,6,10,11,12a-he...
Create Date: 2016-08-02
CID: 121235537

6487. Kynamro; Mipomersen sodium [USAN]; ISIS301012 ...
MW:    7594.800494 g/mol MF: C230H305N67Na19O122P19S19
Create Date: 2016-04-10
CID: 118984460

6488. Asarinin
MW:     354.353320 g/mol MF: C20H18O6
IUPAC name: 5-[(3aR,6R,6aR)-3-(1,3-benzodioxol-5-yl)-1,3,3a,4,6,6a-hexah...
Create Date: 2015-12-22
CID: 102004873

6489. 64854-64-4; Damme; FK-33-824 ...
MW:     603.730140 g/mol MF: C29H41N5O7S
IUPAC name: (2S)-2-amino-N-[(2R)-1-[[2-[[(2S)-1-[[(2S)-1-hydroxy-4-methy...
Create Date: 2015-12-19
CID: 101981638

6490. ATORVASTATIN CALCIUM; 134523-03-8
MW:    1155.341726 g/mol MF: C66H68CaF2N4O10
IUPAC name: calcium;(3R,5R)-7-[2-(4-fluorophenyl)-4-(C-oxido-N-phenylcar...
Create Date: 2015-12-18
CID: 101610369

6491. L-647318; 87770-13-6
MW:     422.597980 g/mol MF: C25H42O5
IUPAC name: [(1S,3S,7S,8S,8aS)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]et...
Create Date: 2015-12-18
CID: 101607775

6492. Rosuvastatin calcium
MW:    1001.137366 g/mol MF: C44H54CaF2N6O12S2
IUPAC name: calcium;(E,3R,5S)-7-[4-(4-fluorophenyl)-2-[methyl(methylsulf...
Create Date: 2015-12-17
CID: 101089689

6493. MSD-883; 77517-29-4
MW:     406.555520 g/mol MF: C24H38O5
IUPAC name: [(1R,3S,4aR,7S,8S,8aS)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-y...
Create Date: 2015-12-15
CID: 100969459

6494. Choline O-sulfate; 4858-96-2
MW:     184.233960 g/mol MF: C5H14NO4S+
IUPAC name: hydron;2-(trimethylazaniumyl)ethyl sulfate
Create Date: 2015-12-11
CID: 100914982

6495. GMP-Pnp; Gpp(NH)p; 5'-Guanylyl-imidodiphosphate trisodium salt hydrate ...
MW:     606.156434 g/mol MF: C10H16N6Na3O14P3
IUPAC name: trisodium;[[(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,...
Create Date: 2015-11-11
CID: 92043290

6496. Colestipol hydrochloride; LP086865; HYDROGEN TETRAETHYLENEPENTAMINE CHLORIDE
MW:     225.762660 g/mol MF: C8H24ClN5
IUPAC name: N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diam...
Create Date: 2015-11-07
CID: 92040146

6497. Betahistine hydrochloride; HE314286
MW:     172.655220 g/mol MF: C8H13ClN2
IUPAC name: hydron;N-methyl-2-pyridin-2-ylethanamine;chloride
Create Date: 2015-11-05
CID: 91991617

6498. STIGMASTANOL; LGJMUZUPVCAVPU-BMPQYNDWSA-N
MW:     416.722580 g/mol MF: C29H52O
IUPAC name: (3S,5S,9S,10S,13R,17R)-17-[(2R)-5-ethyl-6-methylheptan-2-yl]...
Create Date: 2015-04-28
CID: 91746710

6499. ILOPROST; HIFJCPQKFCZDDL-JYTNZNGZSA-N; 6,9.alpha.-Methylene-11.alpha.,15S-dihydroxy-16-methyl-prosta-5E,13E-dien-18-yn-1-oic acid
MW:     360.487080 g/mol MF: C22H32O4
IUPAC name: (5E)-5-[(4R)-5-hydroxy-4-[(E,3S)-3-hydroxy-4-methyloct-1-en-...
Create Date: 2015-04-28
CID: 91746214

6500. Longastatin; Octreotida; Octreotide ...
MW:    1019.239340 g/mol MF: C49H66N10O10S2
IUPAC name: (4R,7S,10S,13R,16S,19R)-10-(4-aminobutyl)-19-[[(2R)-2-amino-...
Create Date: 2014-12-18
CID: 86289069

6501. Clindamycin hydrochloride; 21462-39-5; SY006928
MW:     461.443960 g/mol MF: C18H34Cl2N2O5S
IUPAC name: (2S,4R)-N-[(1R)-2-chloro-1-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6...
Create Date: 2014-11-06
CID: 86222708

6502. KE1SEN21RM
MW:     386.484600 g/mol MF: C22H30N2O4
IUPAC name: (2R)-1-(1,3-benzodioxol-5-yl)-N-methylpropan-2-amine;(2S)-1-...
Create Date: 2014-08-25
CID: 76972761

6503. 403FO0NQG3
MW:     702.725619 g/mol MF: C38H40F6N2O4
IUPAC name: 2-[[(2R)-1-[3-(trifluoromethyl)phenyl]propan-2-yl]amino]ethy...
Create Date: 2014-08-25
CID: 76968312

6504. 63S8C3RXGS
MW:     876.002960 g/mol MF: C54H64Cl2N2O4
IUPAC name: (1R)-2-(4-chlorophenyl)-1-[4-[2-(diethylamino)ethoxy]phenyl]...
Create Date: 2014-08-25
CID: 76968176

6505. TETRAHYDROURIDINE; UNII-0NIZ8H6OL8 component UCKYOOZPSJFJIZ-OZRXBMAMSA-N
MW:     248.233140 g/mol MF: C9H16N2O6
IUPAC name: (4S)-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-...
Create Date: 2014-08-25
CID: 76966528

6506. UNII-3C39BY17Y6; SCHEMBL1033983; 3C39BY17Y6
MW:     324.546000 g/mol MF: C12H20O2S4
IUPAC name: 3-prop-2-enylsulfinylsulfanylprop-1-ene
Create Date: 2014-08-25
CID: 76966351

6507. K9TZK4MNO6
MW:     831.581579 g/mol MF: C38H34Cl2F6N2O8
IUPAC name: 2-acetamidoethyl (2R)-2-(4-chlorophenyl)-2-[3-(trifluorometh...
Create Date: 2014-08-25
CID: 76964262

6508. 39WPC8JHR8
MW:     969.255200 g/mol MF: C56H80N4O10
IUPAC name: (2R)-5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-propan-2...
Create Date: 2014-08-25
CID: 76963933

6509. C2A5X08042
MW:     606.364980 g/mol MF: C24H36I2N2
IUPAC name: (2S)-1-(4-iodophenyl)-N-propan-2-ylpropan-2-amine;(2R)-1-(4-...
Create Date: 2014-08-25
CID: 76962659

6510. USZ5MY269R
MW:     693.695640 g/mol MF: C40H46Cl2O6
IUPAC name: ethyl (2S)-2-[4-[(4-chlorophenyl)methyl]phenoxy]-2-methylbut...
Create Date: 2014-08-25
CID: 76958454

6511. 0S3LDN5P7H
MW:    1637.899520 g/mol MF: C36H34I8N2O8
IUPAC name: ethyl (2S)-2-amino-3-[4-(4-hydroxy-3,5-diiodophenoxy)-3,5-di...
Create Date: 2014-08-25
CID: 76957856

6512. 7JL402PVQR
MW:     709.048040 g/mol MF: C42H76O8
IUPAC name: (2R,3R,4R)-4-hydroxy-2-(7-hydroxyheptyl)-3-[(E,4R)-4-hydroxy...
Create Date: 2014-08-25
CID: 76957410

6513. 093W78U96W
MW:     620.773760 g/mol MF: C40H44O6
IUPAC name: 2-methyl-2-[4-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]phenox...
Create Date: 2014-08-25
CID: 76955952

6514. PIVAMPICILLIN HYDROCHLORIDE; CHEMBL3085479
MW:     500.008100 g/mol MF: C22H30ClN3O6S
IUPAC name: 2,2-dimethylpropanoyloxymethyl (2S,5R,6R)-6-[[(2S)-2-amino-2...
Create Date: 2014-07-29
CID: 76313488

6515. Butaxamine; SCHEMBL15269005; OR253823
MW:     303.824840 g/mol MF: C15H26ClNO3
IUPAC name: 2-(tert-butylamino)-1-(2,5-dimethoxyphenyl)propan-1-ol;hydro...
Create Date: 2014-06-23
CID: 74765081

6516. OXYTETRACYCLINE HYDROCHLORIDE; 2058-46-0
MW:     496.894900 g/mol MF: C22H25ClN2O9
IUPAC name: (4S,4aR,5S,5aR,6S,12aR)-4-(dimethylamino)-1,5,6,10,11,12a-he...
Create Date: 2014-06-23
CID: 74764320

6517. SOFOSBUVIR; SOVALDI; Hepcinat ...
MW:     529.452525 g/mol MF: C22H29FN3O9P
IUPAC name: propan-2-yl (2S)-2-[[[(3R,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)...
Create Date: 2014-04-11
CID: 73425384

6518. F8252JGO9S
MW:     578.308920 g/mol MF: C26H28Cl4O6
IUPAC name: 2-[4-[(1S)-2,2-dichlorocyclopropyl]phenoxy]-2-methylpropanoi...
Create Date: 2014-04-09
CID: 73417183

6519. L628TT009W
MW:     422.515160 g/mol MF: C22H34N2O6
IUPAC name: 4-[(1R)-1-hydroxy-2-(propan-2-ylamino)ethyl]benzene-1,2-diol...
Create Date: 2014-04-09
CID: 73417104

6520. 4L066368AS
MW:     822.931886 g/mol MF: C48H52F2N2O8
IUPAC name: (E,3R,5S)-7-[3-(4-fluorophenyl)-1-propan-2-ylindol-2-yl]-3,5...
Create Date: 2014-04-09
CID: 73416920

6521. SQ 31906 Lactone; 6-Hydroxyisocompactin; 6-Hydroxy-isocompactin ...
MW:     406.512460 g/mol MF: C23H34O6
IUPAC name: [(1S,6S,7R,8S)-6-hydroxy-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2...
Create Date: 2014-02-22
CID: 72792429

6522. SOFOSBUVIR; 1190307-88-0; QC-10465
MW:     529.452525 g/mol MF: C22H29FN3O9P
IUPAC name: propan-2-yl (2S)-2-[[[5-(2,4-dioxopyrimidin-1-yl)-4-fluoro-3...
Create Date: 2014-01-15
CID: 72699160

6523. Mipomersen; Kynamroreg; GTPL7364
MW:    7157.994878 g/mol MF: C230H305N67O122P19S19-19
Create Date: 2013-04-19
CID: 71301230

6524. CHOLESTYRAMINE RESIN; Cholestyramine; CHEMBL2110633
MW:     296.469600 g/mol MF: C21H30N+
IUPAC name: [4-[3-(4-ethylphenyl)butyl]phenyl]-trimethylazanium
Create Date: 2013-02-04
CID: 70695641

6525. CHOLESTYRAMINE RESIN; Colestyramine; CHEMBL2104535
MW:     331.922600 g/mol MF: C21H30ClN
IUPAC name: [4-[3-(4-ethylphenyl)butyl]phenyl]-trimethylazanium;chloride
Create Date: 2013-02-04
CID: 70695640

6526. Azacosterol HCl; SC-12937; Diazacholesterol Dihydrochloride ...
MW:     425.090600 g/mol MF: C25H45ClN2O
IUPAC name: (3S,8R,9S,10R,13S,14S,17S)-17-[3-(dimethylamino)propyl-methy...
Create Date: 2012-11-30
CID: 68422363

6527. PIVAMPICILLIN HYDROCHLORIDE; SCHEMBL9396175; DQECFVGMGBQCPA-DFRGWQKMSA-N ...
MW:     500.008100 g/mol MF: C22H30ClN3O6S
IUPAC name: 2,2-dimethylpropanoyloxymethyl (2S,5R,6R)-6-[(2-amino-2-phen...
Create Date: 2012-11-30
CID: 67841712

6528. FELYPRESSIN; 56-59-7; Felypressin Acetate ...
MW:    1040.218800 g/mol MF: C46H65N13O11S2
IUPAC name: (2S)-N-[(2R)-6-amino-1-[(2-amino-2-oxoethyl)amino]-1-oxohexa...
Create Date: 2012-11-29
CID: 66577116

6529. Dextromethorphan hydrobromide
MW:     370.324420 g/mol MF: C18H28BrNO2
Create Date: 2012-08-08
CID: 57515976

6530. CTK5A5392; 56-59-7; Vasopressin,2-L-phenylalanine-8-L-lysine-
MW:    1040.218800 g/mol MF: C46H65N13O11S2
IUPAC name: (2S)-N-[(2S)-6-amino-1-[(2-amino-2-oxoethyl)amino]-1-oxohexa...
Create Date: 2012-07-12
CID: 57351021

6531. Desmopressin acetate; SCHEMBL22511; CS-O-01345
MW:    1069.216960 g/mol MF: C46H64N14O12S2
IUPAC name: (2R)-N-[(2R)-1-[(2-amino-2-oxoethyl)amino]-5-(diaminomethyli...
Create Date: 2012-06-14
CID: 57201485

6532. Octreotide; SCHEMBL7910; 83150-76-9 ...
MW:    1019.239340 g/mol MF: C49H66N10O10S2
IUPAC name: (4R,7R,10R,13S,16R,19S)-10-(4-aminobutyl)-19-[[(2S)-2-amino-...
Create Date: 2012-06-14
CID: 57181882

6533. CHOLINE CITRATE; ACMC-1BOM4; SCHEMBL119896 ...
MW:     278.279000 g/mol MF: C11H20NO7+
IUPAC name: 2-(3,4-dicarboxy-3-hydroxybutanoyl)oxyethyl-trimethylazanium
Create Date: 2012-03-22
CID: 56846595

6534. 4-(2-(1-(4-chlorocinnamyl)piperazin-4-yl)ethyl)benzoic acid; BM15766; 4-(2-(1-(4-chlorocinnamyl)piperazin-4-yl)ethyl)benzoate ...
MW:     384.899100 g/mol MF: C22H25ClN2O2
IUPAC name: 4-[2-[4-[(E)-3-(4-chlorophenyl)prop-2-enyl]piperazin-1-ium-1...
Create Date: 2012-01-10
CID: 54758559

6535. Arestin; Dynacin; Minocin ...
MW:     493.937320 g/mol MF: C23H28ClN3O7
IUPAC name: (4S,4aS,5aR,12aR)-4,7-bis(dimethylamino)-1,10,11,12a-tetrahy...
Create Date: 2011-12-27
CID: 54751657

6536. demeclocycline; 4-epi-Demeclocycline; 7-Chloro-6-demethyltetracycline ...
MW:     501.313980 g/mol MF: C21H22Cl2N2O8
IUPAC name: 7-chloro-4-(dimethylamino)-1,6,10,11,12a-pentahydroxy-3,12-d...
Create Date: 2011-12-27
CID: 54738647

6537. UNII-C8MRZ07FDV; C8MRZ07FDV; Calcium oxytetracycline ...
MW:     958.930040 g/mol MF: C44H46CaN4O18
IUPAC name: calcium;(6aR,10S,10aR,11S,11aR,12S)-8-carbamoyl-10-(dimethyl...
Create Date: 2011-12-26
CID: 54714250

6538. Terramycin (TN); Oxytetracycline calcium; Oxytetracycline calcium (USP) ...
MW:     498.496080 g/mol MF: C22H22CaN2O9
IUPAC name: calcium;(4S,4aR,5S,5aR,6S,12aR)-2-carbamoyl-4-(dimethylamino...
Create Date: 2011-12-26
CID: 54710745

6539. Pannorin; 137023-81-5; AC1NUPH9 ...
MW:     258.226200 g/mol MF: C14H10O5
IUPAC name: 4,8,10-trihydroxy-5-methylbenzo[h]chromen-2-one
Create Date: 2011-12-26
CID: 54692973

6540. Demetraclin; Novotriclina; Deganol ...
MW:     464.853040 g/mol MF: C21H21ClN2O8
IUPAC name: (4S,4aS,5aS,6S,12aS)-7-chloro-4-(dimethylamino)-3,6,10,11,12...
Create Date: 2011-12-26
CID: 54692151

6541. Bisolvomycin; Hydrocyclin; Tetran hydrochloride ...
MW:     496.894900 g/mol MF: C22H25ClN2O9
IUPAC name: 4-(dimethylamino)-1,5,6,10,11,12a-hexahydroxy-6-methyl-3,12-...
Create Date: 2011-12-26
CID: 54687415

6542. DEMECLOCYCLINE HYDROCHLORIDE; 64-73-3; Demeclocycline HCL ...
MW:     501.313980 g/mol MF: C21H22Cl2N2O8
IUPAC name: (4S,4aS,5aS,6S,12aR)-7-chloro-4-(dimethylamino)-1,6,10,11,12...
Create Date: 2011-12-26
CID: 54686764

6543. Oxytetracycline calcium; EINECS 230-540-4; 79-57-2 (Parent) ...
MW:     498.496080 g/mol MF: C22H22CaN2O9
IUPAC name: calcium;(5S,5aR,6S,6aR,7S,10aR)-9-carbamoyl-7-(dimethylamino...
Create Date: 2011-12-26
CID: 54686182

6544. MINOCYCLINE HYDROCHLORIDE; 13614-98-7; Minocycline HCl ...
MW:     493.937320 g/mol MF: C23H28ClN3O7
IUPAC name: (4S,4aS,5aR,12aR)-4,7-bis(dimethylamino)-1,10,11,12a-tetrahy...
Create Date: 2011-12-26
CID: 54685925

6545. OXYTETRACYCLINE HYDROCHLORIDE; Oxytetracycline HCl; Biosolvomycin ...
MW:     496.894900 g/mol MF: C22H25ClN2O9
IUPAC name: (4S,4aR,5S,5aR,6S,12aR)-4-(dimethylamino)-1,5,6,10,11,12a-he...
Create Date: 2011-12-26
CID: 54680782

6546. 6153-64-6; OXTC; Oxytetracyclini dihydras ...
MW:     496.464520 g/mol MF: C22H28N2O11
IUPAC name: (4S,4aR,5S,5aR,6S,12aR)-4-(dimethylamino)-1,5,6,10,11,12a-he...
Create Date: 2011-12-26
CID: 54680691

6547. demeclocycline; Demeclociclina; Demeclocyclinum ...
MW:     464.853040 g/mol MF: C21H21ClN2O8
IUPAC name: (4S,4aS,5aS,6S,12aR)-7-chloro-4-(dimethylamino)-1,6,10,11,12...
Create Date: 2011-12-26
CID: 54680690

6548. demeclocycline; STK177319; Bioterciclin ...
MW:     464.853040 g/mol MF: C21H21ClN2O8
IUPAC name: 7-chloro-4-(dimethylamino)-1,6,10,11,12a-pentahydroxy-3,12-d...
Create Date: 2011-12-26
CID: 54680103

6549. L-Ascorbyl-2-sulfate; Ascorbic acid 2-sulfate; Ascorbate 2-sulfate ...
MW:     256.187320 g/mol MF: C6H8O9S
IUPAC name: [(2R)-2-[(1S)-1,2-dihydroxyethyl]-3-hydroxy-5-oxo-2H-furan-4...
Create Date: 2011-12-26
CID: 54676864

6550. minocycline; Minocyclin; Minociclina ...
MW:     457.476380 g/mol MF: C23H27N3O7
IUPAC name: (4S,4aS,5aR,12aR)-4,7-bis(dimethylamino)-1,10,11,12a-tetrahy...
Create Date: 2011-12-26
CID: 54675783

6551. oxytetracycline; Terramycin; Oxytetracyclin ...
MW:     460.433960 g/mol MF: C22H24N2O9
IUPAC name: (4S,4aR,5S,5aR,6S,12aR)-4-(dimethylamino)-1,5,6,10,11,12a-he...
Create Date: 2011-12-26
CID: 54675779

6552. Ascorbate 2-sulfate; AC1L983Q; CHEBI:2869 ...
MW:     256.187320 g/mol MF: C6H8O9S
IUPAC name: [(2R)-2-(1,2-dihydroxyethyl)-3-hydroxy-5-oxo-2H-furan-4-yl] ...
Create Date: 2011-12-26
CID: 54675759

6553. Crestor (TN); ZD4522; CHEMBL3542385 ...
MW:     521.615623 g/mol MF: C22H28CaFN3O6S+2
IUPAC name: calcium;(E,3R,5S)-7-[4-(4-fluorophenyl)-2-[methyl(methylsulf...
Create Date: 2011-12-19
CID: 54613184

6554. NSC123019; AY-9944; trans-1,4-Bis(2-dichlorobenzylaminoethyl)cyclohexane hydrochloride ...
MW:     427.838060 g/mol MF: C22H29Cl3N2
IUPAC name: N-[(2-chlorophenyl)methyl]-1-[4-[[(2-chlorophenyl)methylamin...
Create Date: 2011-12-19
CID: 54602908

6555. 153321-50-7; 6-Heptenoic acid,7-[7-([1,1'-biphenyl]-4-ylmethyl)-2-(4-fluorophenyl)-4,5,6,7-tetrahydro-2H-indazol-3-yl]-3,5-dihydroxy-,[3(3S*,5R*,7E),7R*]- (9CI); ACMC-1C95H ...
MW:     540.624523 g/mol MF: C33H33FN2O4
IUPAC name: 7-[2-(4-fluorophenyl)-7-[(4-phenylphenyl)methyl]-4,5,6,7-tet...
Create Date: 2011-12-04
CID: 54048818

6556. Rosuvastatin calcium; 147098-20-2; (3S,5S)-Rosuvastatin Calcium Salt ...
MW:    1001.137366 g/mol MF: C44H54CaF2N6O12S2
IUPAC name: calcium;(E,3S,5S)-7-[4-(4-fluorophenyl)-2-[methyl(methylsulf...
Create Date: 2011-11-16
CID: 53486433

6557. 82576-52-1; AKOS015916504; AC-4541 ...
MW:     428.481520 g/mol MF: C22H28N4O5
IUPAC name: 2-(1-benzylindazol-3-yl)oxyacetic acid;(2R)-2,6-diaminohexan...
Create Date: 2011-11-16
CID: 53486269

6558. ILOPROST; 73873-87-7; AKOS025402197 ...
MW:     360.487080 g/mol MF: C22H32O4
IUPAC name: (5Z)-5-[(3aR,6aR)-5-hydroxy-4-[(E,3R)-3-hydroxy-4-methyloct-...
Create Date: 2011-11-16
CID: 53486260

6559. CTK5D7933; 73390-02-0; Cholest-8-ene-3,15-diol,(3b,5a,15a)- (9CI)
MW:     402.652940 g/mol MF: C27H46O2
IUPAC name: (10S,13R,14R,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-y...
Create Date: 2011-11-07
CID: 53471323

6560. 151106-12-6; 6-Heptenoic acid,7-[3-bromo-4,5-bis(4-fluorophenyl)-2-(1-methylethyl)-1H-pyrrol-1-yl]-3,5-dihydroxy-,methyl ester, (3R,5S,6E)-rel-; ACMC-20n64j ...
MW:     548.416326 g/mol MF: C27H28BrF2NO4
IUPAC name: methyl 7-[4-bromo-2,3-bis(4-fluorophenyl)-5-propan-2-ylpyrro...
Create Date: 2011-10-30
CID: 53435973

6561. atorvastatin calcium trihydrate
MW:    1209.387566 g/mol MF: C66H74CaF2N4O13-2
IUPAC name: calcium;7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5...
Create Date: 2011-10-30
CID: 53396297

6562. ILOPROST; 5-cis Iloprost; 15(R)-Iloprost ...
MW:     360.487080 g/mol MF: C22H32O4
IUPAC name: 5-[5-hydroxy-4-(3-hydroxy-4-methyloct-1-en-6-ynyl)-3,3a,4,5,...
Create Date: 2011-10-30
CID: 53394043

6563. CHEMBL1800808; SCHEMBL531706; Anacetrapib,cas:875446-37-0 ...
MW:     623.481852 g/mol MF: C29H23F10NO3
IUPAC name: (5R)-5-[3,5-bis(trifluoromethyl)phenyl]-3-[[2-(4-fluoro-2-me...
Create Date: 2011-09-26
CID: 53363909

6564. clindamycin; AB01274742-01; AB01274742_02 ...
MW:     424.983020 g/mol MF: C18H33ClN2O5S
IUPAC name: (2S,4R)-N-[(1S)-2-chloro-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydrox...
Create Date: 2011-07-15
CID: 53245639

6565. Clindamycin hydrochloride; Clindoxyl; BenzaClin ...
MW:     461.443960 g/mol MF: C18H34Cl2N2O5S
IUPAC name: (2S,4R)-N-[(1S)-2-chloro-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydrox...
Create Date: 2011-07-15
CID: 53245638

6566. gamma-Oryzanol; gamma Oryzanol; 11042-64-1 ...
MW:     602.886120 g/mol MF: C40H58O4
Create Date: 2011-05-03
CID: 51346127

6567. Evacetrapib; 1186486-62-3; LY2484595 ...
MW:     638.646959 g/mol MF: C31H36F6N6O2
IUPAC name: 4-[[(5S)-5-[[3,5-bis(trifluoromethyl)phenyl]methyl-(2-methyl...
Create Date: 2011-01-17
CID: 49836058

6568. METHYLTHIOINOSINE; 6-Methylthioinosine; MMPR ...
MW:     298.318260 g/mol MF: C11H14N4O4S
IUPAC name: (2S,3R,4R,5R)-2-(hydroxymethyl)-5-(6-methylsulfanylpurin-9-y...
Create Date: 2010-11-09
CID: 46936521

6569. Rosuvastatin calcium; 147098-20-2
MW:    1001.137366 g/mol MF: C44H54CaF2N6O12S2
IUPAC name: calcium;(E,3R,5S)-7-[4-(4-fluorophenyl)-2-[methyl(methylsulf...
Create Date: 2010-07-28
CID: 46783850

6570. Desmopressin acetate; UNII-XB13HYU18U; XB13HYU18U ...
MW:    1183.314760 g/mol MF: C48H74N14O17S2
IUPAC name: acetic acid;(2S)-N-[(2R)-1-[(2-amino-2-oxoethyl)amino]-5-(di...
Create Date: 2010-07-28
CID: 46783812

6571. Cleocin; 58207-19-5
MW:     461.443960 g/mol MF: C18H34Cl2N2O5S
IUPAC name: (2S,4R)-N-[(1S,2R)-2-chloro-1-[(3R,4S,5R,6R)-3,4,5-trihydrox...
Create Date: 2010-07-28
CID: 46783763

6572. clindamycin; 18323-44-9; AKOS015895687
MW:     424.983020 g/mol MF: C18H33ClN2O5S
IUPAC name: (2S,4R)-N-[(1S,2R)-2-chloro-1-[(3R,4S,5R,6R)-3,4,5-trihydrox...
Create Date: 2010-07-28
CID: 46783762

6573. Clindamycin hydrochloride; Cleocin; 21462-39-5 ...
MW:     461.443960 g/mol MF: C18H34Cl2N2O5S
IUPAC name: (2R)-N-[2-chloro-1-[(3R,4R,6R)-3,4,5-trihydroxy-6-methylsulf...
Create Date: 2010-07-26
CID: 46781040

6574. Laminarin; SCHEMBL17408801; 9008-22-4 ...
MW:     504.437080 g/mol MF: C18H32O16
IUPAC name: (2S,3R,4S,5R,6R)-4-[(2S,3R,4S,5R,6R)-3,5-dihydroxy-6-(hydrox...
Create Date: 2010-07-01
CID: 46173707

6575. ATORVASTATIN CALCIUM; 134523-03-8; AKOS015896500
MW:    1195.419726 g/mol MF: C66H68Ca2F2N4O10
IUPAC name: calcium;calcium;(3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(ph...
Create Date: 2010-06-21
CID: 45790066

6576. SOFOSBUVIR; PSI 7977; SOVALDI ...
MW:     529.452525 g/mol MF: C22H29FN3O9P
IUPAC name: propan-2-yl (2S)-2-[[[(2R,3R,4R,5R)-5-(2,4-dioxopyrimidin-1-...
Create Date: 2010-05-17
CID: 45375808

6577. PSI-7851; SOFOSBUVIR; PSI-7977 ...
MW:     529.452525 g/mol MF: C22H29FN3O9P
IUPAC name: propan-2-yl (2S)-2-[[[(2R,3R,4R,5R)-5-(2,4-dioxopyrimidin-1-...
Create Date: 2010-05-17
CID: 45375806

6578. clindamycin; AKOS015960728; AC-12132
MW:     424.983020 g/mol MF: C18H33ClN2O5S
IUPAC name: (2S,4R)-N-[(1R)-2-chloro-1-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6...
Create Date: 2010-05-14
CID: 45357041

6579. 2-deoxyglucose; 2-Desoxy-D-glucose; NSC 15193 ...
MW:     164.156480 g/mol MF: C6H12O5
IUPAC name: (4R,5S)-6-(hydroxymethyl)oxane-2,4,5-triol
Create Date: 2010-03-29
CID: 45038823

6580. Clindamycin Hydrochloride  Monohydrate; 58207-19-5; Clindamycin Hcl ...
MW:     461.443960 g/mol MF: C18H34Cl2N2O5S
IUPAC name: (2S,4R)-N-[2-chloro-1-[(3R,4S)-3,4,5-trihydroxy-6-methylsulf...
Create Date: 2010-03-02
CID: 44629924

6581. Mipomersen; CHEMBL2219536
MW:    7177.145738 g/mol MF: C230H324N67O122P19S19
Create Date: 2010-01-26
CID: 44564108

6582. Octreotide acetate; Octreotide; 83150-76-9 ...
MW:    1019.239340 g/mol MF: C49H66N10O10S2
IUPAC name: (4R,7S,10S,13R,16S,19R)-10-(4-aminobutyl)-19-[[(2R)-2-amino-...
Create Date: 2009-11-19
CID: 44420813

6583. 5-Cedo; Cholest-8-ene-3,15-diol; 73390-02-0 ...
MW:     402.652940 g/mol MF: C27H46O2
IUPAC name: (3S,5S,10S,13R,14R,15S,17R)-10,13-dimethyl-17-[(2R)-6-methyl...
Create Date: 2009-08-20
CID: 44145735

6584. IN1331; FLUVASTATIN SODIUM; Fluvastatin-D8 (Major) Sodium Salt ...
MW:     433.447772 g/mol MF: C24H25FNNaO4
IUPAC name: sodium;7-[3-(4-fluorophenyl)-1-propan-2-ylindol-2-yl]-3,5-di...
Create Date: 2008-09-30
CID: 24906289

6585. IN1025; U-18666A; 3beta-(2-DIETHYLAMINOETHOXY)ANDROSTENONE HYDROCHLORIDE
MW:     424.059480 g/mol MF: C25H42ClNO2
IUPAC name: 3-[2-(diethylamino)ethoxy]-10,13-dimethyl-1,2,3,4,7,8,9,11,1...
Create Date: 2008-09-30
CID: 24906257

6586. Ornipressin (INN); Ornipressin [INN]; (Orn8) Vasopressin ...
MW:    1042.191620 g/mol MF: C45H63N13O12S2
IUPAC name: (2S)-N-[(2S)-5-amino-1-[(2-amino-2-oxoethyl)amino]-1-oxopent...
Create Date: 2008-09-10
CID: 24892846

6587. quinacrine mustard; ICR 10; Mepacrine mustard dihydrochloride ...
MW:     505.307860 g/mol MF: C23H29Cl4N3O
IUPAC name: 1-N,1-N-bis(2-chloroethyl)-4-N-(6-chloro-2-methoxyacridin-9-...
Create Date: 2008-02-29
CID: 24180972

6588. 15-ketocholestane; 3beta-hydroxy-5alpha-cholestan-15-one; CHEBI:61835 ...
MW:     402.652940 g/mol MF: C27H46O2
IUPAC name: (3S,5S,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-17-[(...
Create Date: 2008-02-20
CID: 24003426

6589. GANCICLOVIR SODIUM; 107910-75-8; RS-21592 sodium ...
MW:     277.212449 g/mol MF: C9H12N5NaO4
IUPAC name: sodium;2-amino-9-(1,3-dihydroxypropan-2-yloxymethyl)purin-6-...
Create Date: 2008-02-05
CID: 23700083

6590. 3-Hydroxy-3,5-dihydro ML-236C; 154417-69-3; 3alpha-Hydroxy-3,5-dihydro-ML-236C sodium salt ...
MW:     348.409629 g/mol MF: C18H29NaO5
IUPAC name: sodium;(3R,5R)-7-[(1R,2R,3S,8aR)-3-hydroxy-2-methyl-1,2,3,5,...
Create Date: 2008-02-05
CID: 23695975

6591. 2,6,7-Trideoxy-7-C-(2,4-dichlorophenyl)heptonic acid; Tddcph; 141267-47-2 ...
MW:     345.150969 g/mol MF: C13H15Cl2NaO5
IUPAC name: sodium;(3S,4S,5R)-7-(2,4-dichlorophenyl)-3,4,5-trihydroxyhep...
Create Date: 2008-02-05
CID: 23695972

6592. PD 123244-15; 148750-02-1; 1H-Pyrrole-1-heptanoic acid, 3,4-dibromo-2-(4-fluorophenyl)-beta,delta-dihydroxy-5-(1-methylethyl)-, monosodium salt, (R*,R*)-(+-)- ...
MW:     543.197092 g/mol MF: C20H23Br2FNNaO4
IUPAC name: sodium;(3R,5R)-7-[3,4-dibromo-2-(4-fluorophenyl)-5-propan-2-...
Create Date: 2008-02-05
CID: 23689273

6593. Lithium nicotinate; 53890-72-5; 3-Pyridinecarboxylic acid, lithium salt ...
MW:     129.042460 g/mol MF: C6H4LiNO2
IUPAC name: lithium;pyridine-3-carboxylate
Create Date: 2008-02-05
CID: 23686395

6594. Rosuvastatin; Rosuvastatin Sodium; 147098-18-8 ...
MW:     503.519452 g/mol MF: C22H27FN3NaO6S
IUPAC name: sodium;(E,3R,5S)-7-[4-(4-fluorophenyl)-2-[methyl(methylsulfo...
Create Date: 2008-02-05
CID: 23684378

6595. 69657-51-8; ACYCLOVIR SODIUM; MFCD01694138 ...
MW:     247.186469 g/mol MF: C8H10N5NaO3
IUPAC name: sodium;2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethanolate
Create Date: 2008-02-05
CID: 23683095

6596. FLUVASTATIN SODIUM; 93957-55-2; Lymetel ...
MW:     433.447772 g/mol MF: C24H25FNNaO4
IUPAC name: sodium;(E,3S,5R)-7-[3-(4-fluorophenyl)-1-propan-2-ylindol-2-...
Create Date: 2008-02-05
CID: 23679527

6597. CEFAZOLIN SODIUM; Cefazoline sodium; Cefazolin sodium salt ...
MW:     476.488989 g/mol MF: C14H13N8NaO4S3
IUPAC name: sodium;(6R,7R)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylme...
Create Date: 2008-02-05
CID: 23675322

6598. Bmy 21950; Bmy-21950; GTPL2981 ...
MW:     478.423816 g/mol MF: C23H21F2N4NaO4
IUPAC name: sodium;(3S,5R,6E)-9,9-bis(4-fluorophenyl)-3,5-dihydroxy-8-(1...
Create Date: 2008-02-05
CID: 23665941

6599. ACYCLOVIR SODIUM; 69657-51-8; Sodium 2-((2-amino-6-oxo-1H-purin-9(6H)-yl)methoxy)ethanolate ...
MW:     247.186469 g/mol MF: C8H10N5NaO3
IUPAC name: sodium;2-amino-9-(2-hydroxyethoxymethyl)purin-6-olate
Create Date: 2008-02-05
CID: 23665721

6600. CERIVASTATIN SODIUM; Rivastatin; Baycol ...
MW:     481.532092 g/mol MF: C26H33FNNaO5
IUPAC name: sodium;(E,3R,5S)-7-[4-(4-fluorophenyl)-5-(methoxymethyl)-2,6...
Create Date: 2008-02-05
CID: 23663992

6601. FLUVASTATIN SODIUM; Lescol; Fluvastatin sodium salt ...
MW:     433.447772 g/mol MF: C24H25FNNaO4
IUPAC name: sodium;(E,3R,5S)-7-[3-(4-fluorophenyl)-1-propan-2-ylindol-2-...
Create Date: 2008-02-05
CID: 23663976

6602. SCHEMBL672036; 342-69-8; NU004018
MW:     298.318260 g/mol MF: C11H14N4O4S
IUPAC name: (2R,3S,4R)-2-(hydroxymethyl)-5-(6-methylsulfanylpurin-9-yl)o...
Create Date: 2007-12-12
CID: 23616817

6603. GR 79236; 124555-18-6; BRD-A73929928-311-01-9
MW:     351.357740 g/mol MF: C15H21N5O5
IUPAC name: (2R,3S,5R)-2-[6-[[(1S,2S)-2-hydroxycyclopentyl]amino]purin-9...
Create Date: 2007-12-08
CID: 23581828

6604. PMD-387; CRILVASTATIN; Crilvastatina ...
MW:     253.337320 g/mol MF: C14H23NO3
IUPAC name: (3,3,5-trimethylcyclohexyl) (2S)-5-oxopyrrolidine-2-carboxyl...
Create Date: 2007-12-05
CID: 22845140

6605. 9012-76-4; CHITIN, DEACETYLATED; C6H11NO4X2 ...
MW:    1526.453920 g/mol MF: C56H103N9O39
IUPAC name: methyl N-[5-[3-amino-5-[3-amino-5-[3-amino-5-[3-amino-5-[3-a...
Create Date: 2007-12-05
CID: 21896651

6606. Clindamycin hydrochloride; Cleocin; 21462-39-5 ...
MW:     461.443960 g/mol MF: C18H34Cl2N2O5S
IUPAC name: N-[2-chloro-1-(3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl)pr...
Create Date: 2007-12-05
CID: 21872021

6607. 133983-25-2; disodium (3S)-4-({[1-(4-fluorophenyl)-3-(propan-2-yl)-1H-indol-2-yl]ethynyl}phosphinato)-3-hydroxybutanoate
MW:     487.368244 g/mol MF: C23H21FNNa2O5P
IUPAC name: disodium;4-[2-[1-(4-fluorophenyl)-3-propan-2-ylindol-2-yl]et...
Create Date: 2007-12-05
CID: 21715987

6608. 206184-49-8; tenofovir.H2O; UNII-99YXE507IL ...
MW:     305.227602 g/mol MF: C9H16N5O5P
IUPAC name: [(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethylphosphonic a...
Create Date: 2007-12-05
CID: 21146529

6609. Cholesta-8(14),24-dien-15-one,3-hydroxy-, (3b,5a)- (9CI); CTK4C4121; 144535-22-8 ...
MW:     398.621180 g/mol MF: C27H42O2
IUPAC name: (9R,10S,13R,17R)-3-hydroxy-10,13-dimethyl-17-[(2R)-6-methylh...
Create Date: 2007-12-05
CID: 21121620

6610. Cholest-8(14)-en-15-one,3,25-dihydroxy-, (3b,5a)- (9CI); CTK4B1735; 120185-34-4
MW:     416.636460 g/mol MF: C27H44O3
IUPAC name: (9R,10S,13R,17R)-3-hydroxy-17-[(2R)-6-hydroxy-6-methylheptan...
Create Date: 2007-12-05
CID: 21121089

6611. Cholest-8(14)-en-15-one,3,24-dihydroxy-, (3b,5a)- (9CI); CTK4B1727; 120171-12-2
MW:     416.636460 g/mol MF: C27H44O3
IUPAC name: (9R,10S,13R,17R)-3-hydroxy-17-[(2R)-5-hydroxy-6-methylheptan...
Create Date: 2007-12-05
CID: 21121088

6612. Chol-8(14)-en-15-one,24-(dimethylamino)-3-hydroxy-, (3b,5a)- (9CI); CTK4C0251; 136320-61-1
MW:     401.625120 g/mol MF: C26H43NO2
IUPAC name: (9R,10S,13R,17R)-17-[(2R)-5-(dimethylamino)pentan-2-yl]-3-hy...
Create Date: 2007-12-05
CID: 21120672

6613. STIGMASTANOL; Stigmastan-3.beta.-ol; (8R,9S,10S,13R,14S,17R)-17-((2R,5R)-5-Ethyl-6-methylheptan-2-yl)-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-3-ol ...
MW:     416.722580 g/mol MF: C29H52O
IUPAC name: (8R,9S,10S,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2...
Create Date: 2007-12-05
CID: 20849398

6614. Benzmaleceno; Benzmalecenum; Benzmalecene [INN] ...
MW:     392.275760 g/mol MF: C20H19Cl2NO3
IUPAC name: (Z)-4-[3,4-bis(4-chlorophenyl)butan-2-ylamino]-4-oxobut-2-en...
Create Date: 2007-12-05
CID: 20838642

6615. 141263-69-6; 6-(2,4-Dichlorophenyl)-2,4-dihydroxyhexane-1-sulfonic acid; Benzenehexanesulfonicacid, 2,4-dichloro-b,d-dihydroxy-, monopotassium salt,[R-(R*,R*)]- (9CI) ...
MW:     343.223440 g/mol MF: C12H16Cl2O5S
IUPAC name: 6-(2,4-dichlorophenyl)-2,4-dihydroxyhexane-1-sulfonic acid
Create Date: 2007-12-05
CID: 20835986

6616. UNII-67656KJH8M; Nicomethanol Hydrofluoride; Fluorinol ...
MW:     129.132223 g/mol MF: C6H8FNO
IUPAC name: pyridin-3-ylmethanol;hydrofluoride
Create Date: 2007-12-05
CID: 20333624

6617. 120185-34-4; ACMC-20mos9; Cholest-8(14)-en-15-one,3,25-dihydroxy-, (3b,5a)- (9CI) ...
MW:     416.636460 g/mol MF: C27H44O3
IUPAC name: 3-hydroxy-17-(6-hydroxy-6-methylheptan-2-yl)-10,13-dimethyl-...
Create Date: 2007-12-04
CID: 18953389

6618. 136320-61-1; ACMC-20mw44; Chol-8(14)-en-15-one,24-(dimethylamino)-3-hydroxy-, (3b,5a)- (9CI) ...
MW:     401.625120 g/mol MF: C26H43NO2
IUPAC name: 17-[5-(dimethylamino)pentan-2-yl]-3-hydroxy-10,13-dimethyl-1...
Create Date: 2007-12-04
CID: 18953379

6619. ACMC-20mos3; Cholest-8(14)-en-15-one,3,24-dihydroxy-, (3b,5a)- (9CI); 120171-12-2
MW:     416.636460 g/mol MF: C27H44O3
IUPAC name: 3-hydroxy-17-(5-hydroxy-6-methylheptan-2-yl)-10,13-dimethyl-...
Create Date: 2007-12-04
CID: 18953377

6620. ACMC-20n43i; Cholesta-8(14),24-dien-15-one,3-hydroxy-, (3b,5a)- (9CI); 144535-22-8
MW:     398.621180 g/mol MF: C27H42O2
IUPAC name: 3-hydroxy-10,13-dimethyl-17-(6-methylhept-5-en-2-yl)-1,2,3,4...
Create Date: 2007-12-04
CID: 18953376

6621. Elvorine; Isovorin; Calcium levofolinate ...
MW:     511.501440 g/mol MF: C20H21CaN7O7
IUPAC name: calcium;2-[[4-[[(6S)-2-amino-5-formyl-4-oxo-1,6,7,8-tetrahyd...
Create Date: 2007-12-04
CID: 18641362

6622. Cloprostenol sodium; Cloprostenol sodium salt; (+)-Cloprostenol sodium ...
MW:     446.896889 g/mol MF: C22H28ClNaO6
IUPAC name: sodium;(Z)-7-[(1R,2R,3R,5S)-2-[(E,3R)-4-(3-chlorophenoxy)-3-...
Create Date: 2007-11-30
CID: 17756794

6623. 9,11-Dideoxy-9alpha,11alpha-methanoepoxyprostaglandin F2alpha; U-46619
MW:     350.492260 g/mol MF: C21H34O4
IUPAC name: (Z)-7-[3-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxabicyclo[2.2.1]hep...
Create Date: 2007-11-13
CID: 16760624

6624. Fluvastatin, Sodium Salt; Fluvastatin sodium salt; FLUVASTATIN SODIUM ...
MW:     433.447772 g/mol MF: C24H25FNNaO4
IUPAC name: sodium;(E)-7-[3-(4-fluorophenyl)-1-propan-2-ylindol-2-yl]-3,...
Create Date: 2007-11-13
CID: 16760425

6625. PRAVASTATIN SODIUM; Mevalotin; Elisor ...
MW:     446.509569 g/mol MF: C23H35NaO7
IUPAC name: sodium;(3R,5R)-7-[(1S,2S,6S,8S,8aR)-6-hydroxy-2-methyl-8-[(2...
Create Date: 2007-11-09
CID: 16759173

6626. AMP-PNP; to_000016
MW:     513.137266 g/mol MF: C10H17LiN6O12P3
IUPAC name: [[[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-h...
Create Date: 2007-08-01
CID: 16654005

6627. Rosuvastatin calcium; KS-1109; 147098-20-2 ...
MW:    1001.137366 g/mol MF: C44H54CaF2N6O12S2
IUPAC name: calcium;7-[4-(4-fluorophenyl)-2-[methyl(methylsulfonyl)amino...
Create Date: 2007-07-30
CID: 16413926

6628. beta-Sitostanol; Stigmastan-3beta-ol; STIGMASTANOL ...
MW:     416.722580 g/mol MF: C29H52O
IUPAC name: (5S)-17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,5...
Create Date: 2007-07-16
CID: 16219965

6629. GMP-Pnp; Gpp(NH)p; G0635_SIGMA ...
MW:     588.141154 g/mol MF: C10H14N6Na3O13P3
IUPAC name: trisodium;[[(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,...
Create Date: 2007-07-16
CID: 16219382

6630. U-46619; 9,11-Dideoxy-11|A,9|A-epoxymethanoprostaglandin F2|A; D8174_SIGMA ...
MW:     350.492260 g/mol MF: C21H34O4
IUPAC name: (Z)-7-[(2S,3R)-3-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxabicyclo[2...
Create Date: 2007-07-16
CID: 16219283

6631. Cleocin; Clindamycin hydrochloride; (7S)-7-Chloro-7-deoxylincomycin hydrochloride ...
MW:     461.443960 g/mol MF: C18H34Cl2N2O5S
IUPAC name: (4R)-N-[(1S,2S)-2-chloro-1-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6...
Create Date: 2007-07-16
CID: 16219133

6632. App(NH)p; AMP-PNP; ATP[beta,gamma-NH ...
MW:     547.943786 g/mol MF: C10H15Li4N6O13P3
IUPAC name: tetralithium;[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihyd...
Create Date: 2007-07-16
CID: 16218881

6633. Liraglutide; victoza; Liraglutida ...
MW:    3751.202000 g/mol MF: C172H265N43O51
Create Date: 2007-07-04
CID: 16134956

6634. Rosuvastatin calcium; 147098-20-2; NCGC00095143-01 ...
MW:    1001.137366 g/mol MF: C44H54CaF2N6O12S2
IUPAC name: calcium;(E)-7-[4-(4-fluorophenyl)-2-[methyl(methylsulfonyl)a...
Create Date: 2007-06-19
CID: 16114800

6635. Desmopressin acetate; DSSTox_CID_26864; DSSTox_RID_81971 ...
MW:    1129.268920 g/mol MF: C48H68N14O14S2
IUPAC name: acetic acid;(2S)-N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-5-(di...
Create Date: 2007-05-07
CID: 16051969

6636. Clindamycin hydrochloride; Clindamycin Hcl; Cleocin hydrochloride ...
MW:     461.443960 g/mol MF: C18H34Cl2N2O5S
IUPAC name: (2S,4R)-N-[(1S,2S)-2-chloro-1-[(2R,3R,4S,5R,6R)-3,4,5-trihyd...
Create Date: 2007-05-07
CID: 16051951

6637. DESMOPRESSIN; CHEMBL376685; Desmopresina ...
MW:    1069.216960 g/mol MF: C46H64N14O12S2
IUPAC name: (2S)-N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-5-(diaminomethyli...
Create Date: 2007-05-07
CID: 16051933

6638. STIGMASTANOL; Fucostanol; beta-Sitostanol ...
MW:     416.722580 g/mol MF: C29H52O
IUPAC name: (3S,8R,9S,10S,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylhepta...
Create Date: 2007-02-12
CID: 15559396

6639. ATORVASTATIN CALCIUM; 134523-03-8; Atorvastatin calcium salt ...
MW:    1155.341726 g/mol MF: C66H68CaF2N4O10
IUPAC name: calcium;(3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarb...
Create Date: 2007-02-09
CID: 15378998

6640. SCHEMBL9343408; 3,24-Dhac-8-en-15-one; JHMBRHJGBMZVML-MOTDRCRLSA-N ...
MW:     416.636460 g/mol MF: C27H44O3
IUPAC name: (3S,5S,9R,10S,13R,17R)-3-hydroxy-17-[(2R)-5-hydroxy-6-methyl...
Create Date: 2007-02-09
CID: 15231300

6641. 3beta,25-Dihydroxy-5alpha-cholest-8(14)-en-15-one; 3,25-DCeO; SCHEMBL9348175 ...
MW:     416.636460 g/mol MF: C27H44O3
IUPAC name: (3S,5S,9R,10S,13R,17R)-3-hydroxy-17-[(2R)-6-hydroxy-6-methyl...
Create Date: 2007-02-09
CID: 15125800

6642. 79691-18-2; HE149450; 6-(2-(8-( -4-hydroxy-3,4,5,6-tetrahydro-2H-pyran-2-one ...
MW:     428.536223 g/mol MF: C26H33FO4
IUPAC name: 6-[2-[8-[(4-fluorophenyl)methoxy]-2,6-dimethyl-1,2,6,7,8,8a-...
Create Date: 2007-02-09
CID: 14863780

6643. ACMC-20dgm4; 6'-Hydroxymethylsimvastatin; 114801-27-3 ...
MW:     434.565620 g/mol MF: C25H38O6
IUPAC name: [3-(hydroxymethyl)-8-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-7-m...
Create Date: 2007-02-09
CID: 14373162

6644. Sulodexide; 57821-29-1; DR001136 ...
MW:     295.294480 g/mol MF: C12H17N5O4
IUPAC name: 2-(hydroxymethyl)-4-methoxy-5-[6-(methylamino)purin-9-yl]oxo...
Create Date: 2007-02-09
CID: 14366984

6645. FELYPRESSIN; Felipresina; Felypressine ...
MW:    1040.218800 g/mol MF: C46H65N13O11S2
IUPAC name: (2S)-N-[(2S)-6-amino-1-[(2-amino-2-oxoethyl)amino]-1-oxohexa...
Create Date: 2007-02-09
CID: 14257662

6646. POR 8; ORNIPRESSIN; UNII-1KTH6N080W ...
MW:    1042.191620 g/mol MF: C45H63N13O12S2
IUPAC name: (2S)-N-[(2S)-5-amino-1-[(2-amino-2-oxoethyl)amino]-1-oxopent...
Create Date: 2007-02-09
CID: 14257660

6647. 12-Hete; 71030-37-0; 12-hydroxy-5Z,8Z,10E,14Z-eicosatetraenoic acid ...
MW:     320.466280 g/mol MF: C20H32O3
IUPAC name: (5Z,8Z,10E,14Z)-12-hydroxyicosa-5,8,10,14-tetraenoic acid
Create Date: 2007-02-08
CID: 13786989

6648. 87770-13-6; (1S,3S,4aS)-8-{2-[(2R,4R)-4-hydroxy-6-oxotetrahydro-2H-pyran-2-yl]ethyl}-3,7-dimethyldecahydronaphthalen-1-yl 2,2-dimethylbutanoate
MW:     422.597980 g/mol MF: C25H42O5
IUPAC name: [8-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-3,7-dimethyl-1,2,3,4,...
Create Date: 2007-02-08
CID: 13590073

6649. 6-(2-(2,4-Dichloro-6-hydroxyphenyl)ethyl)-3,4,5,6-tetrahydro-4-hydroxy-2H-pyran-2-one; 95465-60-4; 6-[2-(2,4-dichloro-6-hydroxyphenyl)ethyl]-3,4,5,6-tetrahydro-4-hydroxy-2H-pyran-2-one ...
MW:     305.153860 g/mol MF: C13H14Cl2O4
IUPAC name: 6-[2-(2,4-dichloro-6-hydroxyphenyl)ethyl]-4-hydroxyoxan-2-on...
Create Date: 2007-02-08
CID: 13553196

6650. 78366-44-6; (1S,4aR)-8-{2-[(2R,4R)-4-hydroxy-6-oxotetrahydro-2H-pyran-2-yl]ethyl}-7-methyl-1,2,3,4,4a,7,8,8a-octahydronaphthalen-1-yl (2S)-2-methylbutanoate
MW:     392.528940 g/mol MF: C23H36O5
IUPAC name: [8-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-7-methyl-1,2,3,4,4a,7...
Create Date: 2007-02-08
CID: 13269185

6651. Bendazac L-lysine; Bendazac lysine; 81919-14-4 ...
MW:     428.481520 g/mol MF: C22H28N4O5
IUPAC name: 2-(1-benzylindazol-3-yl)oxyacetic acid;(2S)-2,6-diaminohexan...
Create Date: 2007-02-08
CID: 13041095

6652. Orthoxicol; Dimacol; Romilar ...
MW:     271.397200 g/mol MF: C18H25NO
Create Date: 2007-02-07
CID: 12305042

6653. Rosuvastatin calcium, Crestor; Rosuvastatin calcium; S2169_Selleck ...
MW:    1001.137366 g/mol MF: C44H54CaF2N6O12S2
IUPAC name: calcium;(E,3R,5S)-7-[4-(4-fluorophenyl)-2-[methyl(methylsulf...
Create Date: 2007-02-07
CID: 12136802

6654. m-Iodobenzylguanidine hemisulfate; MIBG; 3-Iodobenzylguanidine hemisulfate ...
MW:     648.257620 g/mol MF: C16H22I2N6O4S
IUPAC name: 2-[(3-iodophenyl)methyl]guanidine;sulfuric acid
Create Date: 2006-12-01
CID: 11957572

6655. Saralasin acetate; Sarenin; Saralasin acetate (USAN) ...
MW:     990.113840 g/mol MF: C44H71N13O13
IUPAC name: acetic acid;(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)...
Create Date: 2006-11-22
CID: 11954381

6656. Azacosterol hydrochloride; UNII-B32804UAUQ; B32804UAUQ ...
MW:     461.551540 g/mol MF: C25H46Cl2N2O
IUPAC name: (3S,8R,9S,10R,13S,14S,17S)-17-[3-(dimethylamino)propyl-methy...
Create Date: 2006-11-22
CID: 11954297

6657. (-)-Asarinin; Asarinin; UNII-333JW641ML ...
MW:     354.353320 g/mol MF: C20H18O6
IUPAC name: 5-[(3R,3aS,6S,6aS)-3-(1,3-benzodioxol-5-yl)-1,3,3a,4,6,6a-he...
Create Date: 2006-11-09
CID: 11869417

6658. Anacetrapib; 875446-37-0; MK-0859 ...
MW:     637.508432 g/mol MF: C30H25F10NO3
IUPAC name: (4S,5R)-5-[3,5-bis(trifluoromethyl)phenyl]-3-[[2-(4-fluoro-2...
Create Date: 2006-10-26
CID: 11556427

6659. ATORVASTATIN CALCIUM; 134523-03-8; AKOS025149638 ...
MW:     597.709863 g/mol MF: C33H34CaFN2O5+
IUPAC name: calcium;(3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarb...
Create Date: 2006-10-26
CID: 11227182

6660. ILOPROST; 15(R)-Iloprost; 85026-51-3 ...
MW:     360.487080 g/mol MF: C22H32O4
IUPAC name: (5Z)-5-[(3aS,4R,5R,6aS)-5-hydroxy-4-[(E,3S)-3-hydroxy-4-meth...
Create Date: 2006-10-26
CID: 10937300

6661. Bendazac lysine; C22H28N4O5; SCHEMBL286933 ...
MW:     428.481520 g/mol MF: C22H28N4O5
IUPAC name: 2-(1-benzylindazol-3-yl)oxyacetic acid;2,6-diaminohexanoic a...
Create Date: 2006-10-25
CID: 10320377

6662. COLESTOLONE; 15-ketocholestene; Colestolona ...
MW:     400.637060 g/mol MF: C27H44O2
IUPAC name: (3S,5S,9R,10S,13R,17R)-3-hydroxy-10,13-dimethyl-17-[(2R)-6-m...
Create Date: 2006-10-25
CID: 10046567

6663. Azacosterol; 313-05-3; 20,25-Diazacholesterol ...
MW:     388.629660 g/mol MF: C25H44N2O
IUPAC name: (3S,8R,9S,10R,13S,14S,17S)-17-[3-(dimethylamino)propyl-methy...
Create Date: 2006-10-25
CID: 10023199

6664. Gardrin; Enprostilum [Latin]; Enprostilo [Spanish] ...
MW:     400.464820 g/mol MF: C23H28O6
IUPAC name: methyl 7-[(1S,2S,3S)-3-hydroxy-2-[(E,3S)-3-hydroxy-4-phenoxy...
Create Date: 2006-10-25
CID: 9978336

6665. U 18666A; 3039-71-2; U18666A ...
MW:     424.059480 g/mol MF: C25H42ClNO2
IUPAC name: (3S,8R,9S,10R,13S,14S)-3-[2-(diethylamino)ethoxy]-10,13-dime...
Create Date: 2006-10-25
CID: 9954082

6666. (16S)-15-deoxy--16-hydroxy-16-methyl-PGE1 methyl ester; methyl 11R,16S-dihydroxy-16-methyl-9-oxoprost-13E-en-1-oate; methyl (11alpha,13E,16S)-11,16-dihydroxy-16-methyl-9-oxoprost-13-en-1-oate ...
MW:     382.534120 g/mol MF: C22H38O5
IUPAC name: methyl 7-[(1R,2R,3R)-3-hydroxy-2-[(E,4S)-4-hydroxy-4-methylo...
Create Date: 2006-10-25
CID: 9886273

6667. GR79236; GR-79236; CHEMBL2163568 ...
MW:     351.357740 g/mol MF: C15H21N5O5
IUPAC name: (2R,3R,4S,5R)-2-[6-[[(1S,2S)-2-hydroxycyclopentyl]amino]puri...
Create Date: 2006-10-25
CID: 9884817

6668. PRAVASTATIN SODIUM; Pravastatin Sodium Salt; 81131-70-6 ...
MW:     447.517509 g/mol MF: C23H36NaO7
IUPAC name: (3R,5R)-7-[(1S,2S,6S,8S,8aR)-6-hydroxy-2-methyl-8-[(2S)-2-me...
Create Date: 2006-10-25
CID: 9868292

6669. CRILVASTATIN; 120551-59-9; Crilvastatin (USAN/INN) ...
MW:     253.337320 g/mol MF: C14H23NO3
IUPAC name: [(1R,5R)-3,3,5-trimethylcyclohexyl] (2S)-5-oxopyrrolidine-2-...
Create Date: 2006-10-25
CID: 9859832

6670. Desmopressin acetate; Octostim; UNII-1K12647SFC ...
MW:    1129.268920 g/mol MF: C48H68N14O14S2
IUPAC name: acetic acid;(2S)-N-[(2R)-1-[(2-amino-2-oxoethyl)amino]-5-(di...
Create Date: 2006-10-25
CID: 9833407

6671. Vytorin; 444313-53-5; INEGY ...
MW:     827.991466 g/mol MF: C49H59F2NO8
IUPAC name: [(1S,3R,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]et...
Create Date: 2006-10-25
CID: 9832423

6672. (S)-Norfenfluramine; d-Norfenfluramine; (+)-norfenfluramine ...
MW:     203.204190 g/mol MF: C10H12F3N
IUPAC name: (2S)-1-[3-(trifluoromethyl)phenyl]propan-2-amine
Create Date: 2006-10-25
CID: 9815618

6673. clindamycin; Chlolincocin; Antirobe ...
MW:     424.983020 g/mol MF: C18H33ClN2O5S
IUPAC name: (2S,4R)-N-[(2S)-2-chloro-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydrox...
Create Date: 2006-10-25
CID: 9812677

6674. L-669262; NPDFVGFXQSJBAA-ZBDDBYLNSA-; InChI=1/C25H36O6/c1-6-25(4,5)24(29)31-21-10-14(2)9-16-11-20(27)15(3)19(23(16)21)8-7-18-12-17(26)13-22(28)30-18/h9,11,15,17-19,21,23,26H,6-8,10,12-13H2,1-5H3/t15-,17-,18-,19+,21+,23+/m1/s1
MW:     432.549740 g/mol MF: C25H36O6
IUPAC name: [(1S,7R,8R,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl...
Create Date: 2006-10-25
CID: 9802864

6675. Isoproterenol sulfate; 6078-56-4; 4-(1-Hydroxy-2-(isopropylamino)ethyl)benzene-1,2-diol sulfate ...
MW:     309.336060 g/mol MF: C11H19NO7S
IUPAC name: 4-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzene-1,2-diol;sulf...
Create Date: 2006-10-25
CID: 9796663

6676. Proguanil hydrochloride; 637-32-1; Paludrine ...
MW:     290.192180 g/mol MF: C11H17Cl2N5
IUPAC name: (1E)-1-[amino-(4-chloroanilino)methylidene]-2-propan-2-ylgua...
Create Date: 2006-10-24
CID: 9570076

6677. TETRAHYDROURIDINE; TYU; SCHEMBL172272 ...
MW:     248.233140 g/mol MF: C9H16N2O6
IUPAC name: (4R)-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-...
Create Date: 2006-08-16
CID: 9543506

6678. Dalcetrapib; 211513-37-0; JTT-705 ...
MW:     389.594500 g/mol MF: C23H35NO2S
IUPAC name: S-[2-[[1-(2-ethylbutyl)cyclohexanecarbonyl]amino]phenyl] 2-m...
Create Date: 2006-07-28
CID: 6918540

6679. Ginsenoside Rb2; Ginsenoside C; NSC 308878 ...
MW:    1079.268500 g/mol MF: C53H90O22
IUPAC name: (2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydrox...
Create Date: 2006-07-28
CID: 6917976

6680. Octreotide acetate; Sandostatin LAR; SMS 201-995 AC ...
MW:    1079.291300 g/mol MF: C51H70N10O12S2
IUPAC name: acetic acid;(4R,7S,10S,13R,16S,19R)-10-(4-aminobutyl)-19-[[(...
Create Date: 2006-07-28
CID: 6917964

6681. Anordrin; alpha-Anordrin; UNII-6R25F2A061 ...
MW:     438.598920 g/mol MF: C28H38O4
IUPAC name: [(2R,3aS,3bS,5aS,6R,8aS,8bR,10aS)-2,6-diethynyl-3a,5a-dimeth...
Create Date: 2006-07-28
CID: 6917889

6682. Preglandin; Cervagem; Ono-802 ...
MW:     394.544820 g/mol MF: C23H38O5
IUPAC name: methyl (E)-7-[(1R,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxy-4,4-d...
Create Date: 2006-07-28
CID: 6917857

6683. dextromethorphan; 125-71-3; SCHEMBL248575 ...
MW:     271.397200 g/mol MF: C18H25NO
Create Date: 2006-07-16
CID: 6916184

6684. U-46619; CBiol_001985; KBioGR_000254 ...
MW:     350.492260 g/mol MF: C21H34O4
IUPAC name: 7-[(1S,2S,3R,4R)-3-[(3S)-3-hydroxyoct-1-enyl]-5-oxabicyclo[2...
Create Date: 2006-06-05
CID: 6610266

6685. MLS000028672; BUTOXAMINE HYDROCHLORIDE; SMR000058900 ...
MW:     303.824840 g/mol MF: C15H26ClNO3
IUPAC name: (1R,2S)-2-(tert-butylamino)-1-(2,5-dimethoxyphenyl)propan-1-...
Create Date: 2006-05-25
CID: 6602683

6686. GR95030X; 6-Heptenoic acid, 7-(4,5-bis(4-fluorophenyl)-2-(1-methylethyl)-1H-imidazol-1-yl)-3,5-dihydroxy-, (S-(R*,S*-(E)))-; AC1O698C ...
MW:     456.481746 g/mol MF: C25H26F2N2O4
IUPAC name: (E)-7-[4,5-bis(4-fluorophenyl)-2-propan-2-ylimidazol-1-yl]-3...
Create Date: 2006-04-29
CID: 6449152

6687. RP-61969; RP 61969; SCHEMBL5597970 ...
MW:     421.460763 g/mol MF: C25H24FNO4
IUPAC name: 4-(4-fluorophenyl)-3-[(E)-2-[(2S,4R)-4-hydroxy-6-oxooxan-2-y...
Create Date: 2006-04-28
CID: 6443973

6688. Biphme-tidha sodium; AC1O5UFZ; LP075620 ...
MW:     540.624523 g/mol MF: C33H33FN2O4
IUPAC name: (E,3R,5S)-7-[(7S)-2-(4-fluorophenyl)-7-[(4-phenylphenyl)meth...
Create Date: 2006-04-28
CID: 6440931

6689. 7-Bbfp-mpdh methyl ester; AC1O5U3I; 7-(3-BROMO-4,5-BIS(4-FLUOROPHENYL)-2-(ISOPROPYL)-1H-PYRROL-1-YL)-3,5-DIHYDROXY-6-HEPTENOIC ACID METHYL ESTER ...
MW:     548.416326 g/mol MF: C27H28BrF2NO4
IUPAC name: methyl (E,3S,5R)-7-[4-bromo-2,3-bis(4-fluorophenyl)-5-propan...
Create Date: 2006-04-28
CID: 6440726

6690. CHEMBL440891; L 645164; 85551-06-0 ...
MW:     354.414623 g/mol MF: C22H23FO3
IUPAC name: (4R,6S)-6-[(E)-2-[2-(4-fluoro-3-methylphenyl)-4,6-dimethylph...
Create Date: 2006-04-28
CID: 6439709

6691. GR-92549; AC1O5RQK; SCHEMBL9646905 ...
MW:     456.481746 g/mol MF: C25H26F2N2O4
IUPAC name: (E,3S,5R)-7-[4,5-bis(4-fluorophenyl)-2-propan-2-ylimidazol-1...
Create Date: 2006-04-28
CID: 6439471

6692. squalestatin 1; Zaragozic acid A; Squalestatin ...
MW:     690.731340 g/mol MF: C35H46O14
IUPAC name: (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetyloxy-5-methyl-3-methyl...
Create Date: 2006-04-28
CID: 6438355

6693. BM 15766; BM-15766; CHEMBL189871 ...
MW:     384.899100 g/mol MF: C22H25ClN2O2
IUPAC name: 4-[2-[4-[(E)-3-(4-chlorophenyl)prop-2-enyl]piperazin-1-yl]et...
Create Date: 2006-04-28
CID: 6437849

6694. Rosuvastatin calcium; calcium (E,3R,5R)-7-[4-(4-fluorophenyl)-2-[methyl(methylsulfonyl)amino]-6-propan-2-ylpyrimidin-5-yl]-3,5-dihydroxyhept-6-enoate; AC1O5M4W ...
MW:    1001.137366 g/mol MF: C44H54CaF2N6O12S2
IUPAC name: calcium;(E,3R,5R)-7-[4-(4-fluorophenyl)-2-[methyl(methylsulf...
Create Date: 2006-04-28
CID: 6436658

6695. ILOPROST; NCGC00181784-01; Ventavis ...
MW:     360.487080 g/mol MF: C22H32O4
IUPAC name: (5E)-5-[(3aS,5R,6aS)-5-hydroxy-4-[(E,3S)-3-hydroxy-4-methylo...
Create Date: 2006-04-28
CID: 6435378

6696. ILOPROST; SCHEMBL15955636; DR001907 ...
MW:     360.487080 g/mol MF: C22H32O4
IUPAC name: (5Z)-5-[(3aS,5R,6aS)-5-hydroxy-4-[(E,3R)-3-hydroxy-4-methylo...
Create Date: 2006-04-28
CID: 6435293

6697. Stigmastan-3-ol, (3.beta.)-; STIGMASTANOL; Stigmastan-3.beta.-ol ...
MW:     416.722580 g/mol MF: C29H52O
IUPAC name: (3S)-17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,5...
Create Date: 2006-04-28
CID: 6432213

6698. Clindamycin hydrochloride; Prestwick_69; 21462-39-5 ...
MW:     461.443960 g/mol MF: C18H34Cl2N2O5S
IUPAC name: (2S,4R)-N-[(1S,2S)-2-chloro-1-[(3R,4S,5R,6R)-3,4,5-trihydrox...
Create Date: 2006-04-14
CID: 6419884

6699. Octreotide; Sandostatin; Octreotida ...
MW:    1019.239340 g/mol MF: C49H66N10O10S2
IUPAC name: (4R,7S,10S,13R,16S,19R)-10-(4-aminobutyl)-19-[[(2R)-2-amino-...
Create Date: 2005-08-01
CID: 6400441

6700. 202138-50-9; Viread; Tenofovir DF ...
MW:     635.514922 g/mol MF: C23H34N5O14P
IUPAC name: [[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(propan-2-...
Create Date: 2006-03-21
CID: 6398764

6701. (3S,5S)-fluvastatin; fluvastatin; CHEMBL170132 ...
MW:     411.465943 g/mol MF: C24H26FNO4
IUPAC name: (E,3S,5S)-7-[3-(4-fluorophenyl)-1-propan-2-ylindol-2-yl]-3,5...
Create Date: 2005-07-11
CID: 6347538

6702. Dcphhs; AC1O3S9G; (2R,4R)-6-(2,4-dichlorophenyl)-2,4-dihydroxyhexane-1-sulfonic acid; potassium ...
MW:     382.321740 g/mol MF: C12H16Cl2KO5S
IUPAC name: (2R,4R)-6-(2,4-dichlorophenyl)-2,4-dihydroxyhexane-1-sulfoni...
Create Date: 2005-08-08
CID: 6336040

6703. Saralasin; 34273-10-4; CHEMBL938 ...
MW:     912.046600 g/mol MF: C42H65N13O10
IUPAC name: (2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-...
Create Date: 2005-12-16
CID: 6324663

6704. proguanil; Chloroguanide; Chlorguanide ...
MW:     253.731240 g/mol MF: C11H16ClN5
IUPAC name: (1E)-1-[amino-(4-chloroanilino)methylidene]-2-propan-2-ylgua...
Create Date: 2005-09-16
CID: 6178111

6705. Betaine hydrochloride; 590-46-5; Acidol ...
MW:     153.607280 g/mol MF: C5H12ClNO2
IUPAC name: 2-(trimethylazaniumyl)acetate;hydrochloride
Create Date: 2006-03-07
CID: 5702209

6706. Levomethorphan; Spectrum_000924; Spectrum2_001021 ...
MW:     271.397200 g/mol MF: C18H25NO
Create Date: 2006-03-07
CID: 5702040

6707. Clindamycin hydrochloride; AC1NWAKL; CCG-39744 ...
MW:     461.443960 g/mol MF: C18H34Cl2N2O5S
IUPAC name: (2S,4R)-N-[2-chloro-1-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-meth...
Create Date: 2006-03-07
CID: 5702025

6708. 100929-53-1; MFCD00133215; Tyr-D-Ala-Gly-N-Methyl-Phe-Gly-ol ...
MW:     573.637960 g/mol MF: C28H39N5O8
IUPAC name: acetic acid;(2S)-2-amino-N-[(2R)-1-[[2-[[(2S)-1-(2-hydroxyet...
Create Date: 2005-08-08
CID: 5485228

6709. Dextromethorphan hydrochloride; UNII-351KFH969D; Morphinan, 3-methoxy-17-methyl-, hydrochloride, (9alpha,13alpha,14alpha)- ...
MW:     307.858140 g/mol MF: C18H26ClNO
Create Date: 2005-08-08
CID: 5483943

6710. Tenofovir disoproxil; 201341-05-1; PMPA prodrug ...
MW:     519.442762 g/mol MF: C19H30N5O10P
IUPAC name: [[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(propan-2-...
Create Date: 2005-08-01
CID: 5481350

6711. Ftivazide; Phthivazid; STK027778 ...
MW:     271.271320 g/mol MF: C14H13N3O3
IUPAC name: N'-[(E)-(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]...
Create Date: 2005-07-19
CID: 5479610

6712. Dextromethorphan hydrobromide; Antussan; Demorphan ...
MW:     352.309140 g/mol MF: C18H26BrNO
Create Date: 2005-06-08
CID: 5464025

6713. DAMGO; glyol; Dagol ...
MW:     513.586000 g/mol MF: C26H35N5O6
IUPAC name: (2S)-2-amino-N-[(2R)-1-[[2-[[(2S)-1-(2-hydroxyethylamino)-1-...
Create Date: 2005-06-24
CID: 5462471

6714. Dextromethorphan hydrobromide; 6700-34-1; Romilar ...
MW:     370.324420 g/mol MF: C18H28BrNO2
Create Date: 2005-06-24
CID: 5462351

6715. PYRITHIAMINE; Pyrithiamine bromide; UNII-6P6JC2S26Y ...
MW:     339.230860 g/mol MF: C14H19BrN4O
IUPAC name: 2-[1-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-methylpyridi...
Create Date: 2004-09-16
CID: 5460202

6716. 11021-13-9; NSC308878; Ginsenoside  Rb2 ...
MW:    1079.268500 g/mol MF: C53H90O22
IUPAC name: 2-[4,5-dihydroxy-6-(hydroxymethyl)-2-[[(3S,5R,8R,9R,10R,12R,...
Create Date: 2006-02-27
CID: 5458674

6717. Methoprene; Manta; ALTOSID ...
MW:     310.471460 g/mol MF: C19H34O3
IUPAC name: propan-2-yl (2E,4E)-11-methoxy-3,7,11-trimethyldodeca-2,4-di...
Create Date: 2005-03-27
CID: 5366546

6718. l-Methorphan; Levomethorphan; Methorphan ...
MW:     271.397200 g/mol MF: C18H25NO
Create Date: 2004-09-16
CID: 5362449

6719. dextromethorphan; d-Methorphan; Delsym ...
MW:     271.397200 g/mol MF: C18H25NO
Create Date: 2005-06-08
CID: 5360696

6720. Vanillaberon; Ftivazid; Phthivazide ...
MW:     271.271320 g/mol MF: C14H13N3O3
IUPAC name: N'-[(Z)-(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]...
Create Date: 2005-03-27
CID: 5359363

6721. Phthivazid; N'-(4-hydroxy-3-methoxybenzylidene)isonicotinohydrazide; AC1NS77O ...
MW:     271.271320 g/mol MF: C14H13N3O3
IUPAC name: N'-[(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]pyri...
Create Date: 2005-03-26
CID: 5355297

6722. 15-Hydroxy-11alpha,9alpha-(epoxymethano)prosta-5,13-dienoic acid; 7-(6-(3-Hydroxy-1-ocentyl)-2-oxabicyclo(2.2.1)hept-5-yl)-5-heptenoate; 5-Heptenoic acid, 7-(6-(3-hydroxy-1-ocentyl)-2-oxabicyclo(2.2.1)hept-5-yl)- ...
MW:     350.492260 g/mol MF: C21H34O4
IUPAC name: (E)-7-[3-[(E)-3-hydroxyoct-1-enyl]-5-oxabicyclo[2.2.1]heptan...
Create Date: 2005-03-25
CID: 5354027

6723. Chloriguane; Proguanile; (hydrochloride) ...
MW:     253.731240 g/mol MF: C11H16ClN5
IUPAC name: (1Z)-1-[amino-(4-chloroanilino)methylidene]-2-propan-2-ylgua...
Create Date: 2005-03-25
CID: 5353897

6724. fluvastatin; CHEBI:38562; FJLGEFLZQAZZCD-VAWYXSNFSA-N ...
MW:     411.465943 g/mol MF: C24H26FNO4
IUPAC name: (E)-7-[3-(4-fluorophenyl)-1-propan-2-ylindol-2-yl]-3,5-dihyd...
Create Date: 2005-03-25
CID: 5353627

6725. 12-Hete; 12-hydroxy-5,8,10,14-icosatetraenoic acid; 12-Hydroxyeicosatetraenoic acid ...
MW:     320.466280 g/mol MF: C20H32O3
IUPAC name: (5E,8E,10E,14E)-12-hydroxyicosa-5,8,10,14-tetraenoic acid
Create Date: 2005-03-25
CID: 5353272

6726. 12-Hydroxyeicosatetraenoic acid; 12-Hete; 12S- ...
MW:     320.466280 g/mol MF: C20H32O3
IUPAC name: (5E,8Z,10Z,12S,14Z)-12-hydroxyicosa-5,8,10,14-tetraenoic aci...
Create Date: 2006-01-13
CID: 5312984

6727. 12-Hete; 12-Hydroxyeicosatetraenoic acid; 5,8,10,14-Eicosatetraenoic acid, 12-hydroxy-, (E,Z,Z,Z)- ...
MW:     320.466280 g/mol MF: C20H32O3
IUPAC name: (5E,8Z,10Z,14Z)-12-hydroxyicosa-5,8,10,14-tetraenoic acid
Create Date: 2006-01-13
CID: 5312983

6728. MLS000028857; CHEMBL521784; U46619 ...
MW:     350.492260 g/mol MF: C21H34O4
IUPAC name: (Z)-7-[(1S,2S,3R,4R)-3-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxabic...
Create Date: 2005-12-16
CID: 5311493

6729. RIOPROSTIL; Rioprostilum [Latin]; Rioprostilo [Spanish] ...
MW:     354.524020 g/mol MF: C21H38O4
IUPAC name: (2R,3R,4R)-4-hydroxy-2-(7-hydroxyheptyl)-3-[(E)-4-hydroxy-4-...
Create Date: 2005-12-16
CID: 5311413

6730. enprostil; 73121-56-9; Gardrin ...
MW:     400.464820 g/mol MF: C23H28O6
IUPAC name: methyl 7-[(1R,2R,3R)-3-hydroxy-2-[(E,3R)-3-hydroxy-4-phenoxy...
Create Date: 2005-12-16
CID: 5311225

6731. ILOPROST; Ciloprost; Ventavis ...
MW:     360.487080 g/mol MF: C22H32O4
IUPAC name: (5E)-5-[(3aS,4R,5R,6aS)-5-hydroxy-4-[(E,3S)-3-hydroxy-4-meth...
Create Date: 2005-12-16
CID: 5311181

6732. DESMOPRESSIN; UNII-ENR1LLB0FP; DDAVP ...
MW:    1069.216960 g/mol MF: C46H64N14O12S2
IUPAC name: (2S)-N-[(2R)-1-[(2-amino-2-oxoethyl)amino]-5-(diaminomethyli...
Create Date: 2005-12-16
CID: 5311065

6733. cloprostenol; (+)-Cloprostenol; 40665-92-7 ...
MW:     424.915060 g/mol MF: C22H29ClO6
IUPAC name: (Z)-7-[(1R,2R,3R,5S)-2-[(E,3R)-4-(3-chlorophenoxy)-3-hydroxy...
Create Date: 2005-12-16
CID: 5311053

6734. ACIPIMOX; 51037-30-0; Olbetam ...
MW:     154.123440 g/mol MF: C6H6N2O3
IUPAC name: 5-methyl-4-oxidopyrazin-4-ium-2-carboxylic acid
Create Date: 2005-12-16
CID: 5310993

6735. DIBROMOMANNITOL; Dibromannit; Dibromannitol ...
MW:     307.965080 g/mol MF: C6H12Br2O4
IUPAC name: (2R,3S,4S,5R)-1,6-dibromohexane-2,3,4,5-tetrol
Create Date: 2005-11-20
CID: 5284381

6736. 12(R)-HETE; 12R-HETE; 82337-46-0 ...
MW:     320.466280 g/mol MF: C20H32O3
IUPAC name: (5Z,8Z,10E,12R,14Z)-12-hydroxyicosa-5,8,10,14-tetraenoic aci...
Create Date: 2006-01-13
CID: 5283156

6737. 16,16-Dimethyl-pge2; 16,16-dimethylprostaglandin E2; 16,16-Dimethyl-prostaglandin E2 ...
MW:     380.518240 g/mol MF: C22H36O5
IUPAC name: (Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(E,3R)-3-hydroxy-4,4-dimethyl...
Create Date: 2006-01-13
CID: 5283066

6738. Arbaprostil; Arbacet; 55028-70-1 ...
MW:     366.491660 g/mol MF: C21H34O5
IUPAC name: (Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(E,3R)-3-hydroxy-3-methyloct-...
Create Date: 2006-01-13
CID: 5283064

6739. Rosuvastatin calcium; Crestor; Rosuvastatin hemicalcium ...
MW:    1001.137366 g/mol MF: C44H54CaF2N6O12S2
IUPAC name: calcium;(E,3R,5S)-7-[4-(4-fluorophenyl)-2-[methyl(methylsulf...
Create Date: 2005-10-11
CID: 5282455

6740. Pitavastatin; Itavastatin; NK 104 ...
MW:     421.460763 g/mol MF: C25H24FNO4
IUPAC name: (E,3R,5S)-7-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-...
Create Date: 2005-10-11
CID: 5282452

6741. Pitavastatin calcium; 147526-32-7; Livalo ...
MW:     880.983646 g/mol MF: C50H46CaF2N2O8
IUPAC name: calcium;(E,3R,5S)-7-[2-cyclopropyl-4-(4-fluorophenyl)quinoli...
Create Date: 2005-10-11
CID: 5282451

6742. misoprostol; Cytotec; 59122-46-2 ...
MW:     382.534120 g/mol MF: C22H38O5
IUPAC name: methyl 7-[(1R,2R,3R)-3-hydroxy-2-[(E)-4-hydroxy-4-methyloct-...
Create Date: 2005-10-11
CID: 5282381

6743. gamma-Oryzanol; HI-Z; UNII-3PQR2YON9T ...
MW:     602.886120 g/mol MF: C40H58O4
Create Date: 2005-06-24
CID: 5282164

6744. cerulenin; Helicocerin; 17397-89-6 ...
MW:     223.268280 g/mol MF: C12H17NO3
IUPAC name: (2R,3S)-3-[(4E,7E)-nona-4,7-dienoyl]oxirane-2-carboxamide
Create Date: 2005-06-24
CID: 5282054

6745. Glenvastatin; HR 780; AC1NQZCV ...
MW:     431.498643 g/mol MF: C27H26FNO3
IUPAC name: (4R,6S)-6-[(E)-2-[4-(4-fluorophenyl)-6-phenyl-2-propan-2-ylp...
Create Date: 2005-06-24
CID: 5281970

6746. Azetidinecarboxylic acid; L-azetidine-2-carboxylate; AC1NRUXC ...
MW:     101.103880 g/mol MF: C4H7NO2
IUPAC name: azetidin-1-ium-2-carboxylate
Create Date: 2005-10-07
CID: 5248351

6747. GR 79236X; GR 79236; AC1ND7MV ...
MW:     351.357740 g/mol MF: C15H21N5O5
IUPAC name: 2-[6-[(2-hydroxycyclopentyl)amino]purin-9-yl]-5-(hydroxymeth...
Create Date: 2005-09-15
CID: 4545575

6748. Etiroxate hydrochloride; Etiroxate HCl; AC1MJ3TZ ...
MW:     855.410700 g/mol MF: C18H18ClI4NO4
IUPAC name: ethyl 2-amino-3-[4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodop...
Create Date: 2005-08-09
CID: 3085082

6749. Lestid; Colestipol HCl; Flavored Colestid ...
MW:     225.762660 g/mol MF: C8H24ClN5
IUPAC name: N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diam...
Create Date: 2005-08-09
CID: 3084661

6750. Hoet-PO; AC1MJ0P7; [(3S,5R,8R,9S,10R,12S,13R,14S,17R)-17-[(3R,5R)-3,5-dihydroxy-7-oxoheptyl]-3-hydroxy-10,13-dimethyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-12-yl] 2-methylbutanoate ...
MW:     518.725100 g/mol MF: C31H50O6
IUPAC name: [(3S,5R,8R,9S,10R,12S,13R,14S,17R)-17-[(3R,5R)-3,5-dihydroxy...
Create Date: 2005-08-09
CID: 3083482

6751. CHEMBL148721; Momc acid; AC1MIZNT ...
MW:     356.453780 g/mol MF: C19H32O6
IUPAC name: (3R)-3-hydroxy-7-[(1R,2S)-2-[[(2S)-2-methylbutanoyl]oxymethy...
Create Date: 2005-08-09
CID: 3082870

6752. 13552-81-3; Phospho-ADP ribose; AC1MIVIO ...
MW:     639.295646 g/mol MF: C15H24N5O17P3
IUPAC name: [(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-4-hydroxy-5-[[hydroxy(p...
Create Date: 2005-08-09
CID: 3080692

6753. Dcphhp; 6-(2,4-Dichlorophenyl)-erythro-2,4-dihydroxyhexylphosphonic acid; 141263-54-9 ...
MW:     343.140142 g/mol MF: C12H17Cl2O5P
IUPAC name: [(2R,4R)-6-(2,4-dichlorophenyl)-2,4-dihydroxyhexyl]phosphoni...
Create Date: 2005-08-08
CID: 3036097

6754. 50673-97-7; AC1MHV3K; MLS006011685 ...
MW:     400.637060 g/mol MF: C27H44O2
IUPAC name: (3S,5S,10S,13R,17R)-3-hydroxy-10,13-dimethyl-17-[(2R)-6-meth...
Create Date: 2005-08-08
CID: 3033012

6755. Zearalanol; ZERANOL; alpha-Zearalanol ...
MW:     322.396040 g/mol MF: C18H26O5
IUPAC name: (7R,11S)-7,15,17-trihydroxy-11-methyl-12-oxabicyclo[12.4.0]o...
Create Date: 2005-07-30
CID: 2999413

6756. ethionamide; 536-33-4; Ethinamide ...
MW:     166.243400 g/mol MF: C8H10N2S
IUPAC name: 2-ethylpyridine-4-carbothioamide
Create Date: 2005-03-25
CID: 2761171

6757. Iobenguane sulfate; MIBG; 103346-16-3 ...
MW:     373.168050 g/mol MF: C8H12IN3O4S
IUPAC name: 2-[(3-iodophenyl)methyl]guanidine;sulfuric acid
Create Date: 2005-07-19
CID: 2759362

6758. 50673-97-7; 17-(1,5-DIMETHYLHEXYL)-3-HYDROXY-10,13-DIMETHYL-2,3,4,5,6,7,9,10,11,12,13,15,16,17-TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN-15-ONE; 5-alpha-Cholest-8(14)-en-3-beta-ol-15-one ...
MW:     400.637060 g/mol MF: C27H44O2
IUPAC name: 3-hydroxy-10,13-dimethyl-17-(6-methylheptan-2-yl)-1,2,3,4,5,...
Create Date: 2005-07-19
CID: 2738130

6759. fluvastatin; Fluvastatina; Fluvastatine ...
MW:     411.465943 g/mol MF: C24H26FNO4
IUPAC name: (E,3S,5R)-7-[3-(4-fluorophenyl)-1-propan-2-ylindol-2-yl]-3,5...
Create Date: 2005-06-24
CID: 1548972

6760. propylthiouracil; 6-Propyl-2-thiouracil; 51-52-5 ...
MW:     170.232100 g/mol MF: C7H10N2OS
IUPAC name: 6-propyl-2-sulfanylidene-1H-pyrimidin-4-one
Create Date: 2004-09-16
CID: 657298

6761. IPTG; 367-93-1; Isopropyl-beta-D-thiogalactopyranoside ...
MW:     238.301220 g/mol MF: C9H18O5S
IUPAC name: (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-propan-2-ylsulfanyloxan...
Create Date: 2005-06-24
CID: 656894

6762. Torvast; Totalip; 344423-98-9 ...
MW:    1209.387566 g/mol MF: C66H74CaF2N4O13
IUPAC name: calcium;(3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarb...
Create Date: 2005-06-24
CID: 656846

6763. Isoproterenol sulfate; 6700-39-6; Isoprenaline sulfate (JAN) ...
MW:     556.624200 g/mol MF: C22H40N2O12S
IUPAC name: 4-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzene-1,2-diol;sulf...
Create Date: 2005-06-24
CID: 656677

6764. 1,6-Dibromo-1,6-dideoxy-D-mannitol; mitobronitol; Myebrol ...
MW:     307.965080 g/mol MF: C6H12Br2O4
IUPAC name: (2S,3S,4S,5S)-1,6-dibromohexane-2,3,4,5-tetrol
Create Date: 2005-06-24
CID: 656655

6765. Rosuvastatin calcium; AC1LCV9Y; C44H54CaF2N6O12S2 ...
MW:    1001.137366 g/mol MF: C44H54CaF2N6O12S2
IUPAC name: calcium;(3R,5S)-7-[4-(4-fluorophenyl)-2-[methyl(methylsulfon...
Create Date: 2005-06-24
CID: 656605

6766. Dibekacin sulfate; 58580-55-5; DKB sulfate ...
MW:     549.593560 g/mol MF: C18H39N5O12S
IUPAC name: (2S,3R,4S,5S,6R)-4-amino-2-[(1S,2S,3R,4S,6R)-4,6-diamino-3-[...
Create Date: 2005-06-24
CID: 636364

6767. Betaine hydrochloride; Acidol; Methanaminium, 1-carboxy-N,N,N-trimethyl-, chloride ...
MW:     153.607280 g/mol MF: C5H12ClNO2
IUPAC name: carboxymethyl(trimethyl)azanium;chloride
Create Date: 2005-03-27
CID: 521862

6768. dibekacin; Panamicin; Orbicin ...
MW:     451.515080 g/mol MF: C18H37N5O8
IUPAC name: (2S,3R,4S,5S,6R)-4-amino-2-[(1S,2S,3R,4S,6R)-4,6-diamino-3-[...
Create Date: 2005-08-01
CID: 470999

6769. Tenofovir; 147127-20-6; Apropovir ...
MW:     287.212322 g/mol MF: C9H14N5O4P
IUPAC name: [(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethylphosphonic a...
Create Date: 2005-08-01
CID: 464205

6770. Clionasterol; GAMMA-SITOSTEROL; 22,23-Dihydroporiferasterol ...
MW:     414.706700 g/mol MF: C29H50O
IUPAC name: (3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-5-ethyl-6-methylhepta...
Create Date: 2005-08-01
CID: 457801

6771. AC1L9S9I; 9008-22-4; VA11143 ...
MW:     504.437080 g/mol MF: C18H32O16
IUPAC name: 4-[3,5-dihydroxy-6-(hydroxymethyl)-4-[3,4,5-trihydroxy-6-(hy...
Create Date: 2005-08-01
CID: 455149

6772. Octreotide; Sandostatin; 79517-01-4 ...
MW:    1019.239340 g/mol MF: C49H66N10O10S2
IUPAC name: (4R,7S,10S,13R,16S,19R)-10-(4-aminobutyl)-19-[[(2R)-2-amino-...
Create Date: 2005-06-24
CID: 448601

6773. clindamycin; 18323-44-9; Chlolincocin ...
MW:     424.983020 g/mol MF: C18H33ClN2O5S
IUPAC name: (2S,4R)-N-[(1S,2S)-2-chloro-1-[(2R,3R,4S,5R,6R)-3,4,5-trihyd...
Create Date: 2005-06-24
CID: 446598

6774. Rosuvastatin; 287714-41-4; CHEMBL1496 ...
MW:     481.537623 g/mol MF: C22H28FN3O6S
IUPAC name: (E,3R,5S)-7-[4-(4-fluorophenyl)-2-[methyl(methylsulfonyl)ami...
Create Date: 2005-06-24
CID: 446157

6775. cerivastatin; cerivastatin acid; Lipobay ...
MW:     459.550263 g/mol MF: C26H34FNO5
IUPAC name: (E,3R,5S)-7-[4-(4-fluorophenyl)-5-(methoxymethyl)-2,6-di(pro...
Create Date: 2005-06-24
CID: 446156

6776. fluvastatin; Lescol; 93957-54-1 ...
MW:     411.465943 g/mol MF: C24H26FNO4
IUPAC name: (E,3R,5S)-7-[3-(4-fluorophenyl)-1-propan-2-ylindol-2-yl]-3,5...
Create Date: 2005-06-24
CID: 446155

6777. SAQUINAVIR; 127779-20-8; Invirase ...
MW:     670.840800 g/mol MF: C38H50N6O5
IUPAC name: (2S)-N-[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)-3,4,...
Create Date: 2005-06-24
CID: 441243

6778. Clindamycin hydrochloride; AC1LCVGH; Dalacin (TN) ...
MW:     461.443960 g/mol MF: C18H34Cl2N2O5S
IUPAC name: (2S,4R)-N-[2-chloro-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-m...
Create Date: 2005-06-24
CID: 441204

6779. Laminaran; Laminarin; LAMINARAN (FROM EISENIA BICYCLIS) ...
MW:     504.437080 g/mol MF: C18H32O16
IUPAC name: (3R,4S,5R,6R)-4-[(3R,4S,5R,6R)-3,5-dihydroxy-6-(hydroxymethy...
Create Date: 2005-06-24
CID: 439306

6780. 2-deoxyglucose; CHEBI:84755; (4R,5S,6R)-6-(Hydroxymethyl)oxane-2,4,5-triol ...
MW:     164.156480 g/mol MF: C6H12O5
IUPAC name: (4R,5S,6R)-6-(hydroxymethyl)oxane-2,4,5-triol
Create Date: 2005-06-24
CID: 439268

6781. NSC308878; 11021-13-9; AC1L8THL ...
MW:    1079.268500 g/mol MF: C53H90O22
IUPAC name: 2-[4,5-dihydroxy-6-(hydroxymethyl)-2-[[12-hydroxy-4,4,8,10,1...
Create Date: 2005-03-26
CID: 432450

6782. Ro 31-8959; AC1L8P1B; NSC-722663
MW:     766.946460 g/mol MF: C39H54N6O8S
IUPAC name: (2S)-N-[(2S,3R)-4-[(3R,4aR,8aR)-3-(tert-butylcarbamoyl)-3,4,...
Create Date: 2005-03-26
CID: 405421

6783. Octreotide; Sandostatine; Octreotide Acetate Salt ...
MW:    1019.239340 g/mol MF: C49H66N10O10S2
IUPAC name: 10-(4-aminobutyl)-19-[(2-amino-3-phenylpropanoyl)amino]-16-b...
Create Date: 2005-03-26
CID: 383414

6784. Octreotide (acetate); Octreotide acetate; Sandostatin LAR ...
MW:    1079.291300 g/mol MF: C51H70N10O12S2
IUPAC name: acetic acid;10-(4-aminobutyl)-19-[(2-amino-3-phenylpropanoyl...
Create Date: 2005-03-26
CID: 383413

6785. Radecol; Ronicol retard; Spectrum_001274 ...
MW:     259.212720 g/mol MF: C10H13NO7
IUPAC name: 2,3-dihydroxybutanedioic acid;pyridin-3-ylmethanol
Create Date: 2005-03-26
CID: 287442

6786. TETRAHYDROURIDINE; 4-hydroxy-1-pentofuranosyltetrahydro-2(1h)-pyrimidinone; NSC112907 ...
MW:     248.233140 g/mol MF: C9H16N2O6
IUPAC name: 1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-hydroxy-1,3...
Create Date: 2005-03-26
CID: 270480

6787. Spinastanol; Fucostanol; Dihydrositosterin ...
MW:     416.722580 g/mol MF: C29H52O
IUPAC name: (3S,5S,8R,9S,10S,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylhe...
Create Date: 2005-03-26
CID: 241572

6788. 6-Methylmercaptopurine riboside; 6-Methylthioinosine; 13153-62-3 ...
MW:     298.318260 g/mol MF: C11H14N4O4S
IUPAC name: 2-(hydroxymethyl)-5-(6-methylsulfanylpurin-9-yl)oxolane-3,4-...
Create Date: 2005-03-26
CID: 237358

6789. Asarinin; NSC31773; AC1L5PT5 ...
MW:     354.353320 g/mol MF: C20H18O6
IUPAC name: 5-[(3S,3aS,6aS)-3-(1,3-benzodioxol-5-yl)-1,3,3a,4,6,6a-hexah...
Create Date: 2005-03-26
CID: 233333

6790. NSC9965; 6-methoxy-1,4,6,7,9,10,12,13-octahydro-3h,5h-pyrano[4',3':3,4]pyrido[2,1-i]indol-3-one; DH.beta.E ...
MW:     275.342840 g/mol MF: C16H21NO3
Create Date: 2005-03-26
CID: 222907

6791. BETA-SITOSTEROL; Sitosterol; 83-46-5 ...
MW:     414.706700 g/mol MF: C29H50O
IUPAC name: (3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylhepta...
Create Date: 2005-03-26
CID: 222284

6792. ZERANOL; MLS000028828; SMR000058866 ...
MW:     322.396040 g/mol MF: C18H26O5
IUPAC name: (7R)-7,15,17-trihydroxy-11-methyl-12-oxabicyclo[12.4.0]octad...
Create Date: 2005-08-09
CID: 216284

6793. Betahistine hydrochloride; 15430-48-5; MLS000069505 ...
MW:     172.655220 g/mol MF: C8H13ClN2
IUPAC name: N-methyl-2-pyridin-2-ylethanamine;hydrochloride
Create Date: 2005-08-09
CID: 203875

6794. Betahistine mesylate; 54856-23-4; Meginalisk ...
MW:     328.405600 g/mol MF: C10H20N2O6S2
IUPAC name: methanesulfonic acid;N-methyl-2-pyridin-2-ylethanamine
Create Date: 2005-06-24
CID: 198334

6795. Benfluorex hydrochloride; 23642-66-2; Lipophoral ...
MW:     387.823750 g/mol MF: C19H21ClF3NO2
IUPAC name: 2-[1-[3-(trifluoromethyl)phenyl]propan-2-ylamino]ethyl benzo...
Create Date: 2005-07-19
CID: 198015

6796. Dihydromevinolin; 4a,5-Dihydromevinolin; AC1L51VD ...
MW:     406.555520 g/mol MF: C24H38O5
IUPAC name: [(1S,3S,4aR,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-y...
Create Date: 2005-08-09
CID: 196514

6797. Dihydrocompactin; 4a,5-Dihydrocompactin; AC1L514M ...
MW:     392.528940 g/mol MF: C23H36O5
IUPAC name: [(1S,4aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-7-me...
Create Date: 2005-08-09
CID: 196089

6798. 6-Hydroxydopamine hydrobromide; 636-00-0; Oxidopamine hydrobromide ...
MW:     250.089780 g/mol MF: C8H12BrNO3
IUPAC name: 5-(2-aminoethyl)benzene-1,2,4-triol;hydrobromide
Create Date: 2005-07-19
CID: 176170

6799. Desmopressin acetate; 16789-98-3; 1-{[7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-benzyl-16-(4-hydroxybenzyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosan-4-yl]carbonyl}prolyl-n5-(diaminomethylidene)ornithylglycinamide acetate(1:2) ...
MW:    1189.320880 g/mol MF: C50H72N14O16S2
IUPAC name: acetic acid;N-[1-[(2-amino-2-oxoethyl)amino]-5-(diaminomethy...
Create Date: 2005-08-08
CID: 167569

6800. Anordiol; AF 45 (pharmaceutical); UNII-5G6H10Z92J ...
MW:     326.472400 g/mol MF: C22H30O2
IUPAC name: (2R,3aS,3bS,5aS,6R,8aS,8bR,10aS)-2,6-diethynyl-3a,5a-dimethy...
Create Date: 2005-08-08
CID: 164779

6801. (1s,3r,7r,8r,8as)-3-(hydroxymethyl)-8-{2-[(2r,4r)-4-hydroxy-6-oxotetrahydro-2h-pyran-2-yl]ethyl}-7-methyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2,2-dimethylbutanoate; 114801-27-3; AC1Q5WYI ...
MW:     434.565620 g/mol MF: C25H38O6
IUPAC name: [(1S,3R,7R,8R,8aS)-3-(hydroxymethyl)-8-[2-[(2R,4R)-4-hydroxy...
Create Date: 2005-08-08
CID: 163941

6802. Panimycin; Debecacin sulfate; Dibekacin sulphate ...
MW:     547.577680 g/mol MF: C18H37N5O12S-2
IUPAC name: (2S,3R,4S,5S,6R)-4-amino-2-[(1S,2S,3R,4S,6R)-4,6-diamino-3-[...
Create Date: 2005-08-08
CID: 162862

6803. epsilon-Atp; Etheno adenosine triphosphate; BRN 1236001 ...
MW:     531.202426 g/mol MF: C12H16N5O13P3
IUPAC name: [[(2R,3S,4R)-3,4-dihydroxy-5-imidazo[2,1-f]purin-3-yloxolan-...
Create Date: 2005-08-08
CID: 162262

6804. 6-Hydroxydopamine hydrochloride; Oxidopamine hydrochloride; 28094-15-7 ...
MW:     205.638780 g/mol MF: C8H12ClNO3
IUPAC name: 5-(2-aminoethyl)benzene-1,2,4-triol;hydrochloride
Create Date: 2005-08-08
CID: 160157

6805. Colesevelam; Welchol; CholestaGel ...
MW:     618.248880 g/mol MF: C31H67Cl3N4O
IUPAC name: 2-(chloromethyl)oxirane;prop-2-en-1-amine;N-prop-2-enyldecan...
Create Date: 2005-08-08
CID: 160051

6806. Torcetrapib; 262352-17-0; CP-529414 ...
MW:     600.473329 g/mol MF: C26H25F9N2O4
IUPAC name: ethyl (2R,4S)-4-[[3,5-bis(trifluoromethyl)phenyl]methyl-meth...
Create Date: 2005-08-08
CID: 159325

6807. Ezetimibe; 163222-33-1; Zetia ...
MW:     409.425246 g/mol MF: C24H21F2NO3
IUPAC name: (3R,4S)-1-(4-fluorophenyl)-3-[(3S)-3-(4-fluorophenyl)-3-hydr...
Create Date: 2005-06-24
CID: 150311

6808. Levoleucovorin; Citrovorum factor; L-Folinic acid ...
MW:     473.439320 g/mol MF: C20H23N7O7
IUPAC name: (2S)-2-[[4-[[(6S)-2-amino-5-formyl-4-oxo-1,6,7,8-tetrahydrop...
Create Date: 2004-09-16
CID: 149436

6809. 90761-31-2; DCPHH; AC1L3SST ...
MW:     289.154460 g/mol MF: C13H14Cl2O3
IUPAC name: 6-[2-(2,4-dichlorophenyl)ethyl]-4-hydroxyoxan-2-one
Create Date: 2005-08-08
CID: 146230

6810. 87770-13-6; L-647318; L 647318 ...
MW:     422.597980 g/mol MF: C25H42O5
IUPAC name: [(1S,3S,4aS)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-3...
Create Date: 2005-08-08
CID: 137350

6811. 85798-96-5; AC1L35U5; 3I+/--Hydroxy Pravastatin Lactone ...
MW:     406.512460 g/mol MF: C23H34O6
IUPAC name: [6-hydroxy-8-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-7-methyl-1,...
Create Date: 2005-08-08
CID: 135102

6812. BUTOXAMINE; Butaxamin; 78995-65-0 ...
MW:     267.363900 g/mol MF: C15H25NO3
IUPAC name: (1R,2S)-2-(tert-butylamino)-1-(2,5-dimethoxyphenyl)propan-1-...
Create Date: 2005-06-29
CID: 134495

6813. (3|A,5xi)-3-hydroxylanost-8-en-24-one; 24-Ketolanosterol; 853-17-8 ...
MW:     442.716800 g/mol MF: C30H50O2
IUPAC name: (6R)-6-[(3S,10S,13R,14R,17R)-3-hydroxy-4,4,10,13,14-pentamet...
Create Date: 2005-08-08
CID: 133542

6814. (4r,6r)-6-(2-{(1r,2r,8r,8as)-8-[(4-fluorobenzyl)oxy]-2,6-dimethyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl}ethyl)-4-hydroxytetrahydro-2h-pyran-2-one; 6-Fnpo; (4R,6R)-6-[2-[(1R,2R,8R,8aS)-8-[(4-fluorophenyl)methoxy]-2,6-dimethyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-4-hydroxyoxan-2-one ...
MW:     428.536223 g/mol MF: C26H33FO4
IUPAC name: (4R,6R)-6-[2-[(1R,2R,8R,8aS)-8-[(4-fluorophenyl)methoxy]-2,6...
Create Date: 2005-08-08
CID: 133260

6815. 3-Hhceo; AC1L31WO; SCHEMBL9343913 ...
MW:     526.570302 g/mol MF: C27H37F7O2
IUPAC name: (3S,5S,9R,10S,13R,17R)-3-hydroxy-10,13-dimethyl-17-[(2R)-6,7...
Create Date: 2005-08-08
CID: 132962

6816. 3-Hac-8,24-dien-15-one; AC1L31C8; SCHEMBL9345349 ...
MW:     398.621180 g/mol MF: C27H42O2
IUPAC name: (3S,5S,9R,10S,13R,17R)-3-hydroxy-10,13-dimethyl-17-[(2R)-6-m...
Create Date: 2005-08-08
CID: 132637

6817. 141240-46-2; 6-(2,4-Dichlorophenyl)-2,3,4-trihydroxyhexanesulfonic acid; Dcpths ...
MW:     359.222840 g/mol MF: C12H16Cl2O6S
IUPAC name: 6-(2,4-dichlorophenyl)-2,3,4-trihydroxyhexane-1-sulfonic aci...
Create Date: 2005-08-08
CID: 132338

6818. SQ 33600; AC1L2ZMH; SCHEMBL5597751 ...
MW:     487.368244 g/mol MF: C23H21FNNa2O5P
IUPAC name: disodium;(3S)-4-[2-[1-(4-fluorophenyl)-3-propan-2-ylindol-2-...
Create Date: 2005-08-08
CID: 131696

6819. Ibrolipim; NO-1886; 133208-93-2 ...
MW:     451.250862 g/mol MF: C19H20BrN2O4P
IUPAC name: N-(4-bromo-2-cyanophenyl)-4-(diethoxyphosphorylmethyl)benzam...
Create Date: 2005-08-08
CID: 131601

6820. [(1r)-7,7-dimethyl-2-oxobicyclo[2.2.1]hept-1-yl]methanesulfonic acid-(13as)-9,10-dimethoxy-5,8,13,13a-tetrahydro-6h-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinoline(1:1); 80799-31-1; AC1Q2CEO ...
MW:     571.681680 g/mol MF: C30H37NO8S
Create Date: 2005-08-08
CID: 131277

6821. L 669262; 130468-11-0; AC1L2YSI ...
MW:     432.549740 g/mol MF: C25H36O6
IUPAC name: [(1S,7S,8S,8aS)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl...
Create Date: 2005-08-08
CID: 131221

6822. GR 79236X; GR 79236; 124555-18-6 ...
MW:     351.357740 g/mol MF: C15H21N5O5
IUPAC name: (2S,3S,4S,5R)-2-[6-[(2-hydroxycyclopentyl)amino]purin-9-yl]-...
Create Date: 2005-08-08
CID: 130214

6823. 3-(2-Methoxyethoxy)cholest-5-ene; Mpoe cholesterol; 99559-58-7 ...
MW:     444.732680 g/mol MF: C30H52O2
IUPAC name: 3-(2-methoxyethoxy)-10,13-dimethyl-17-(6-methylheptan-2-yl)-...
Create Date: 2005-03-27
CID: 127365

6824. 3-Hdceo; AC1L2PY8; SCHEMBL9348006 ...
MW:     401.625120 g/mol MF: C26H43NO2
IUPAC name: (3S,5S,9R,10S,13R,17R)-17-[(2R)-5-(dimethylamino)pentan-2-yl...
Create Date: 2005-08-08
CID: 126222

6825. Dchpepo; AC1L2OF2; HE419342 ...
MW:     305.153860 g/mol MF: C13H14Cl2O4
IUPAC name: (4S,6S)-6-[2-(2,4-dichloro-6-hydroxyphenyl)ethyl]-4-hydroxyo...
Create Date: 2005-08-08
CID: 125334

6826. xymedon; Xymedone; Ximedon ...
MW:     168.193080 g/mol MF: C8H12N2O2
IUPAC name: 1-(2-hydroxyethyl)-4,6-dimethylpyrimidin-2-one
Create Date: 2005-03-27
CID: 121931

6827. MEDICA 16; 3,3,14,14-Tetramethylhexadecanedioic acid; 87272-20-6 ...
MW:     342.513320 g/mol MF: C20H38O4
IUPAC name: 3,3,14,14-tetramethylhexadecanedioic acid
Create Date: 2005-08-08
CID: 121871

6828. Procorum; GALLOPAMIL HYDROCHLORIDE; 16662-46-7 ...
MW:     521.088540 g/mol MF: C28H41ClN2O5
IUPAC name: 5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-propan-2-yl-2...
Create Date: 2005-06-24
CID: 119442

6829. Anordiol; 2,17,Diethynyl-2,17-dihydroxy-A-norandrostane; (1r,3as,3br,5as,7s,8as,8bs,10as)-1,7-diethynyl-8a,10a-dimethylhexadecahydrodicyclopenta[a,f]naphthalene-1,7-diol ...
MW:     326.472400 g/mol MF: C22H30O2
IUPAC name: (2S,3aS,3bS,5aS,6R,8aS,8bR,10aS)-2,6-diethynyl-3a,5a-dimethy...
Create Date: 2005-08-08
CID: 119043

6830. Cholestane-3,5,6-triol; 115510-05-9; Cholestane-3,5,6-triol(9CI) ...
MW:     420.668220 g/mol MF: C27H48O3
IUPAC name: (8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylhept...
Create Date: 2005-08-08
CID: 115361

6831. TOFA; 5-(Tetradecyloxy)-2-furoic acid; 54857-86-2 ...
MW:     324.454980 g/mol MF: C19H32O4
IUPAC name: 5-tetradecoxyfuran-2-carboxylic acid
Create Date: 2005-08-08
CID: 115175

6832. 154-17-6; 2-Deoxy-D-arabinohexose; UNII-9G2MP84A8W ...
MW:     164.156480 g/mol MF: C6H12O5
IUPAC name: (3R,4S,5R)-3,4,5,6-tetrahydroxyhexanal
Create Date: 2004-09-16
CID: 108223

6833. propidium iodide; 25535-16-4; Propidium diiodide ...
MW:     668.394600 g/mol MF: C27H34I2N4
IUPAC name: 3-(3,8-diamino-6-phenylphenanthridin-5-ium-5-yl)propyl-dieth...
Create Date: 2005-08-08
CID: 104981

6834. 9-Arabinofuranosyladenine; 9|A-d-arabinofuranosyladenine; Arabinofuranosyladenine ...
MW:     267.241320 g/mol MF: C10H13N5O4
IUPAC name: (3S,4S,5R)-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,...
Create Date: 2005-08-08
CID: 102198

6835. Oxythiamine chloride hydrochloride; OXYTHIAMINE CHLORIDE HCL; Hydroxythiamine chloride hydrochloride ...
MW:     338.253280 g/mol MF: C12H17Cl2N3O2S
IUPAC name: 5-[[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium-3-yl]methy...
Create Date: 2005-08-08
CID: 101796

6836. 9-|A-d-arabinofuranosyladenine; alpha-D-Arabinofuranosyladenine; NSC70422 ...
MW:     267.241320 g/mol MF: C10H13N5O4
IUPAC name: (2S,3S,4S,5R)-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolane...
Create Date: 2005-08-01
CID: 96368

6837. Danaden; Niacol; Ronicol timespan ...
MW:     259.212720 g/mol MF: C10H13NO7
IUPAC name: (2R,3R)-2,3-dihydroxybutanedioic acid;pyridin-3-ylmethanol
Create Date: 2005-06-24
CID: 93578

6838. 5alpha,6beta-Dihydroxycholestanol; Cholestane-3beta,5alpha,6beta-triol; Cholesta-3beta,5alpha,6beta-triol ...
MW:     420.668220 g/mol MF: C27H48O3
IUPAC name: (3S,5R,6R,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-m...
Create Date: 2005-03-26
CID: 91498

6839. 1H-Pyrazolo[3,4-d]pyrimidin-4-amine; 4-Aminopyrazolo[3,4-d]pyrimidine; 2380-63-4 ...
MW:     135.126700 g/mol MF: C5H5N5
IUPAC name: 1H-pyrazolo[3,4-d]pyrimidin-4-amine
Create Date: 2005-03-26
CID: 75420

6840. s-Butyrylthiocholine iodide; 1866-16-6; Butyrylthiocholine iodide ...
MW:     317.230670 g/mol MF: C9H20INOS
IUPAC name: 2-butanoylsulfanylethyl(trimethyl)azanium;iodide
Create Date: 2005-07-19
CID: 74630

6841. Ginsenoside C; (3|A,12|A)-20-{[(3xi)-6-o-(|A-l-arabinopyranosyl)-|A-d-ribo-hexopyranosyl]oxy}-12-hydroxydammar-24-en-3-yl 2-o-|A-d-glucopyranosyl-|A-d-glucopyranoside; gingenoside C ...
MW:    1079.268500 g/mol MF: C53H90O22
IUPAC name: (2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydrox...
Create Date: 2005-08-08
CID: 73598

6842. sesamin; Fagarol; Sezamin ...
MW:     354.353320 g/mol MF: C20H18O6
IUPAC name: 5-[(3S,3aR,6S,6aR)-3-(1,3-benzodioxol-5-yl)-1,3,3a,4,6,6a-he...
Create Date: 2005-06-24
CID: 72307

6843. Chitosan; Deacetylchitin; Poliglusam ...
MW:    1526.453920 g/mol MF: C56H103N9O39
IUPAC name: methyl N-[(2S,3R,4R,5S,6R)-5-[(2S,3R,4R,5S,6R)-3-amino-5-[(2...
Create Date: 2005-08-08
CID: 71853

6844. Nicotinic acid hydrochloride; Niacin hydrochloride; 636-79-3 ...
MW:     159.570340 g/mol MF: C6H6ClNO2
IUPAC name: pyridine-3-carboxylic acid;hydrochloride
Create Date: 2005-03-27
CID: 71558

6845. MDMA hydrochloride; DL-MDMA hydrochloride; 64057-70-1 ...
MW:     229.703240 g/mol MF: C11H16ClNO2
IUPAC name: 1-(1,3-benzodioxol-5-yl)-N-methylpropan-2-amine;hydrochlorid...
Create Date: 2005-08-08
CID: 71285

6846. 3-Iodobenzylguanidine; Iobenguane (131I); 131I-MIBG ...
MW:     279.091225 g/mol MF: C8H10IN3
IUPAC name: 2-[(3-iodanylphenyl)methyl]guanidine
Create Date: 2005-03-27
CID: 71184

6847. Biniwas; 69047-39-8; UNII-9NGZ4GPE20 ...
MW:     498.912320 g/mol MF: C25H23ClN2O7
IUPAC name: [2-[2-(4-chlorophenoxy)-2-methylpropanoyl]oxy-3-(pyridine-3-...
Create Date: 2005-08-08
CID: 68884

6848. Plafibride; Idonor; Perifunal ...
MW:     355.816580 g/mol MF: C16H22ClN3O4
IUPAC name: 2-(4-chlorophenoxy)-2-methyl-N-(morpholin-4-ylmethylcarbamoy...
Create Date: 2005-08-08
CID: 68822

6849. Betahistine dihydrochloride; 5579-84-0; Antivom ...
MW:     209.116160 g/mol MF: C8H14Cl2N2
IUPAC name: N-methyl-2-pyridin-2-ylethanamine;dihydrochloride
Create Date: 2005-08-08
CID: 68643

6850. 6-Azauracil; 461-89-2; 1,2,4-Triazine-3,5(2H,4H)-dione ...
MW:     113.074820 g/mol MF: C3H3N3O2
IUPAC name: 2H-1,2,4-triazine-3,5-dione
Create Date: 2005-03-26
CID: 68037

6851. 31637-97-5; Lipo-Merz; C18H18ClNO5 ...
MW:     363.792220 g/mol MF: C18H18ClNO5
IUPAC name: 2-[2-(4-chlorophenoxy)-2-methylpropanoyl]oxyethyl pyridine-3...
Create Date: 2005-08-08
CID: 65777

6852. Etiroxate; 17365-01-4; CG-635 ...
MW:     818.949760 g/mol MF: C18H17I4NO4
IUPAC name: ethyl 2-amino-3-[4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodop...
Create Date: 2005-08-08
CID: 65683

6853. Allicin; Diallyl thiosulfinate; 539-86-6 ...
MW:     162.273000 g/mol MF: C6H10OS2
IUPAC name: 3-prop-2-enylsulfinylsulfanylprop-1-ene
Create Date: 2005-03-26
CID: 65036

6854. 9-(2-Phosphonomethoxypropyl)adenine; rac Tenofovir-d6; 107021-12-5 ...
MW:     287.212322 g/mol MF: C9H14N5O4P
IUPAC name: 1-(6-aminopurin-9-yl)propan-2-yloxymethylphosphonic acid
Create Date: 2005-08-01
CID: 64987

6855. Clofop; 26129-32-8; 2-[4-(4-Chlorophenoxy)phenoxy]propanoic acid ...
MW:     292.714320 g/mol MF: C15H13ClO4
IUPAC name: 2-[4-(4-chlorophenoxy)phenoxy]propanoic acid
Create Date: 2005-03-26
CID: 64928

6856. Stimate; Desmopressin acetate; Stimate injection ...
MW:    1183.314760 g/mol MF: C48H74N14O17S2
IUPAC name: acetic acid;N-[1-[(2-amino-2-oxoethyl)amino]-5-(diaminomethy...
Create Date: 2005-06-24
CID: 64759

6857. Mevastatin; compactin; 73573-88-3 ...
MW:     390.513060 g/mol MF: C23H34O5
IUPAC name: [(1S,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl...
Create Date: 2005-08-08
CID: 64715

6858. COLESTIPOL; Colestid; Cholestabyl ...
MW:     281.825920 g/mol MF: C11H28ClN5O
IUPAC name: N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diam...
Create Date: 2005-03-26
CID: 62816

6859. Saquinavir mesylate; Invirase; 149845-06-7 ...
MW:     766.946460 g/mol MF: C39H54N6O8S
IUPAC name: (2S)-N-[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)-3,4,...
Create Date: 2005-06-24
CID: 60934

6860. Iobenguane; MIBG; meta-Iodobenzylguanidine ...
MW:     275.089570 g/mol MF: C8H10IN3
IUPAC name: 2-[(3-iodophenyl)methyl]guanidine
Create Date: 2005-07-19
CID: 60860

6861. lamivudine; 134678-17-4; Epivir ...
MW:     229.256240 g/mol MF: C8H11N3O3S
IUPAC name: 4-amino-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyr...
Create Date: 2005-08-01
CID: 60825

6862. atorvastatin; 134523-00-5; Cardyl ...
MW:     558.639803 g/mol MF: C33H35FN2O5
IUPAC name: (3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5...
Create Date: 2005-06-24
CID: 60823

6863. ATORVASTATIN CALCIUM; 134523-03-8; Lipitor ...
MW:    1155.341726 g/mol MF: C66H68CaF2N4O10
IUPAC name: calcium;(3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarb...
Create Date: 2005-06-24
CID: 60822

6864. saguinavir; 1hxb; 2fgu ...
MW:     670.840800 g/mol MF: C38H50N6O5
IUPAC name: (2S)-N-[(2S,3R)-4-[(3S)-3-(tert-butylcarbamoyl)-3,4,4a,5,6,7...
Create Date: 2005-08-08
CID: 60787

6865. CRILVASTATIN; 3,3,5-trimethylcyclohexyl 5-oxoprolinate; AC1L1TST ...
MW:     253.337320 g/mol MF: C14H23NO3
IUPAC name: (3,3,5-trimethylcyclohexyl) 5-oxopyrrolidine-2-carboxylate
Create Date: 2005-08-08
CID: 60724

6866. pravastatin; 81093-37-0; Pravachol ...
MW:     424.527740 g/mol MF: C23H36O7
IUPAC name: (3R,5R)-7-[(1S,2S,6S,8S,8aR)-6-hydroxy-2-methyl-8-[(2S)-2-me...
Create Date: 2005-06-24
CID: 54687

6867. simvastatin; 79902-63-9; Zocor ...
MW:     418.566220 g/mol MF: C25H38O5
IUPAC name: [(1S,3R,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]et...
Create Date: 2005-06-24
CID: 54454

6868. Octreotide acetate; Sandostatin LAR Depot; 19-(2-amino-3-phenylpropanamido)-10-(4-aminobutyl)-16-benzyl-N-[(2R,3R)-1,3-dihydroxybutan-2-yl]-7-(1-hydroxyethyl)-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosane-4-carboxamide; bis(acetic acid) ...
MW:    1139.343260 g/mol MF: C53H74N10O14S2
IUPAC name: acetic acid;10-(4-aminobutyl)-19-[(2-amino-3-phenylpropanoyl...
Create Date: 2005-08-08
CID: 54373

6869. lovastatin; mevinolin; Mevacor ...
MW:     404.539640 g/mol MF: C24H36O5
IUPAC name: [(1S,3R,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]et...
Create Date: 2005-06-24
CID: 53232

6870. 55937-99-0; Sgd 24774; Sgd 247-74 ...
MW:     346.847820 g/mol MF: C20H23ClO3
IUPAC name: ethyl 2-[4-[(4-chlorophenyl)methyl]phenoxy]-2-methylbutanoat...
Create Date: 2005-08-08
CID: 51348

6871. didanosine; 2',3'-Dideoxyinosine; 69655-05-6 ...
MW:     236.227280 g/mol MF: C10H12N4O3
IUPAC name: 9-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one
Create Date: 2005-06-24
CID: 50599

6872. BUSERELIN; 57982-77-1; Etilamide ...
MW:    1239.424240 g/mol MF: C60H86N16O13
IUPAC name: (2S)-N-[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2R)-1-[[(2S)-1-...
Create Date: 2005-06-24
CID: 50225

6873. Buserelin acetate; BUSERELIN; Receptal ...
MW:    1299.476200 g/mol MF: C62H90N16O15
IUPAC name: acetic acid;(2S)-N-[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2R)...
Create Date: 2005-06-24
CID: 50224

6874. Damme; Sandoz 33-824; Sandoz FK 33-824 ...
MW:     603.730140 g/mol MF: C29H41N5O7S
IUPAC name: 2-amino-N-[1-[[2-[[1-[(1-hydroxy-4-methylsulfinylbutan-2-yl)...
Create Date: 2005-03-26
CID: 47470

6875. Duolip; 54504-70-0; ML 1024 ...
MW:     420.846840 g/mol MF: C19H21ClN4O5
IUPAC name: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl 2-(4-chlorophenoxy...
Create Date: 2005-03-26
CID: 41109

6876. 41859-67-0; Bezalip; Cedur ...
MW:     361.819400 g/mol MF: C19H20ClNO4
IUPAC name: 2-[4-[2-[(4-chlorobenzoyl)amino]ethyl]phenoxy]-2-methylpropa...
Create Date: 2005-06-24
CID: 39042

6877. GTP-gamma-S; gamma-Thio-GTP; CHEBI:43000 ...
MW:     539.246026 g/mol MF: C10H16N5O13P3S
IUPAC name: [[(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydrox...
Create Date: 2005-06-24
CID: 37792

6878. ribavirin; 36791-04-5; Tribavirin ...
MW:     244.204680 g/mol MF: C8H12N4O5
IUPAC name: 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]...
Create Date: 2005-06-24
CID: 37542

6879. PROPYLBENZILYLCHOLINE MUSTARD; 36167-80-3; Benzeneacetic acid, alpha-hydroxy-alpha-phenyl-, 2-((2-chloroethyl)propylamino)ethyl ester ...
MW:     375.889040 g/mol MF: C21H26ClNO3
IUPAC name: 2-[2-chloroethyl(propyl)amino]ethyl 2-hydroxy-2,2-diphenylac...
Create Date: 2005-08-08
CID: 37396

6880. Sar-Arg-Val-Tyr-Val-His-Pro-Ala; Saralasinum [INN-Latin]; Saralasin [INN:BAN] ...
MW:     912.046600 g/mol MF: C42H65N13O10
IUPAC name: 2-[[1-[2-[[2-[[2-[[2-[[5-(diaminomethylideneamino)-2-[[2-(me...
Create Date: 2005-08-08
CID: 36736

6881. guanylyl imidodiphosphate; GppNHp; GMP-Pnp ...
MW:     522.195666 g/mol MF: C10H17N6O13P3
IUPAC name: [[[[(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydr...
Create Date: 2005-06-08
CID: 36735

6882. 5,7-DIHYDROXYTRYPTAMINE; 3-(2-Aminoethyl)-1H-indole-5,7-diol; 31363-74-3 ...
MW:     192.214480 g/mol MF: C10H12N2O2
IUPAC name: 3-(2-aminoethyl)-1H-indole-5,7-diol
Create Date: 2005-08-08
CID: 35781

6883. zidovudine; Azidothymidine; 3'-Azido-3'-deoxythymidine ...
MW:     267.241320 g/mol MF: C10H13N5O4
IUPAC name: 1-[(2R,4S,5S)-4-azido-5-(hydroxymethyl)oxolan-2-yl]-5-methyl...
Create Date: 2005-06-24
CID: 35370

6884. HALOFENATE; 26718-25-2; MK 185 ...
MW:     415.790790 g/mol MF: C19H17ClF3NO4
IUPAC name: 2-acetamidoethyl 2-(4-chlorophenyl)-2-[3-(trifluoromethyl)ph...
Create Date: 2005-08-08
CID: 33584

6885. ZERANOL; A-ZEARALANOL; AC1L1PSB ...
MW:     322.396040 g/mol MF: C18H26O5
IUPAC name: (11S)-7,15,17-trihydroxy-11-methyl-12-oxabicyclo[12.4.0]octa...
Create Date: 2005-08-08
CID: 33534

6886. Pivampicillin; Pivampicilina; Pivampicilline ...
MW:     463.547160 g/mol MF: C22H29N3O6S
IUPAC name: 2,2-dimethylpropanoyloxymethyl (2S,5R,6R)-6-[[(2R)-2-amino-2...
Create Date: 2005-06-24
CID: 33478

6887. Alphacilina; Alphacillin; Sanguicillin ...
MW:     500.008100 g/mol MF: C22H30ClN3O6S
IUPAC name: 2,2-dimethylpropanoyloxymethyl (2S,5R,6R)-6-[[(2R)-2-amino-2...
Create Date: 2005-08-08
CID: 33477

6888. cefazolin; Cephazolin; Cefazoline ...
MW:     454.507160 g/mol MF: C14H14N8O4S3
IUPAC name: (6R,7R)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-8...
Create Date: 2005-06-24
CID: 33255

6889. gamma-Imino-ATP; ADENYLYL IMIDODIPHOSPHATE; AMPPNP ...
MW:     506.196266 g/mol MF: C10H17N6O12P3
IUPAC name: [[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-...
Create Date: 2005-06-08
CID: 33113

6890. Vidarabine; 24356-66-9; Ara-A ...
MW:     285.256600 g/mol MF: C10H15N5O5
IUPAC name: (2R,3S,4S,5R)-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolane...
Create Date: 2005-06-24
CID: 32326

6891. Dihydro-beta-erythroidine; DHbetaE; B-Idroeritroidina [Italian] ...
MW:     275.342840 g/mol MF: C16H21NO3
Create Date: 2005-06-24
CID: 31762

6892. CHOLINE HYDROXIDE; 123-41-1; Gossypine ...
MW:     121.178100 g/mol MF: C5H15NO2
IUPAC name: 2-hydroxyethyl(trimethyl)azanium;hydroxide
Create Date: 2005-07-19
CID: 31255

6893. Methyl clofenapate; CLOFENAPATE; 21340-68-1 ...
MW:     304.768080 g/mol MF: C17H17ClO3
IUPAC name: methyl 2-[4-(4-chlorophenyl)phenoxy]-2-methylpropanoate
Create Date: 2005-08-08
CID: 30602

6894. TETRAHYDROURIDINE; 3,4,5,6-Tetrahydrouridine; NSC-112907 ...
MW:     248.233140 g/mol MF: C9H16N2O6
IUPAC name: 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]...
Create Date: 2005-08-01
CID: 29243

6895. clindamycin; Clinimycin; Clindamicina ...
MW:     424.983020 g/mol MF: C18H33ClN2O5S
IUPAC name: (2S,4R)-N-[2-chloro-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-m...
Create Date: 2005-06-24
CID: 29029

6896. Adiuretin; DESMOPRESSIN; Adiuretin SD ...
MW:    1069.216960 g/mol MF: C46H64N14O12S2
IUPAC name: N-[1-[(2-amino-2-oxoethyl)amino]-5-(diaminomethylideneamino)...
Create Date: 2005-06-24
CID: 27991

6897. thiamphenicol; 15318-45-3; Thiophenicol ...
MW:     356.222200 g/mol MF: C12H15Cl2NO5S
IUPAC name: 2,2-dichloro-N-[(1R,2R)-1,3-dihydroxy-1-(4-methylsulfonylphe...
Create Date: 2005-06-24
CID: 27200

6898. Ara-CTP; Cytosine arabinoside triphosphate; Arabinosylcytosine triphosphate ...
MW:     483.156326 g/mol MF: C9H16N3O14P3
IUPAC name: [[(2R,3S,4S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydrox...
Create Date: 2005-08-01
CID: 25774

6899. L-Ethionine; Ethionine; 13073-35-3 ...
MW:     163.237920 g/mol MF: C6H13NO2S
IUPAC name: (2S)-2-amino-4-ethylsulfanylbutanoic acid
Create Date: 2005-06-24
CID: 25674

6900. zalcitabine; 2',3'-DIDEOXYCYTIDINE; 7481-89-2 ...
MW:     211.217820 g/mol MF: C9H13N3O3
IUPAC name: 4-amino-1-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-...
Create Date: 2005-06-24
CID: 24066

6901. TIADENOL; Thiadenol; Fonlipol ...
MW:     294.516800 g/mol MF: C14H30O2S2
IUPAC name: 2-[10-(2-hydroxyethylsulfanyl)decylsulfanyl]ethanol
Create Date: 2005-03-26
CID: 23403

6902. ZERANOL; T0500-8836; 7,14,16-Trihydroxy-3-methyl-3,4,5,6,7,8,9,10,11,12-decahydro-1H-2-benzoxacyclotetradecin-1-one ...
MW:     322.396040 g/mol MF: C18H26O5
IUPAC name: 7,15,17-trihydroxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1...
Create Date: 2005-03-27
CID: 22283

6903. 3beta-Sitosterol; 24-Ethylcholesterol; Stigmast-5-en-3-ol ...
MW:     414.706700 g/mol MF: C29H50O
IUPAC name: (8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2...
Create Date: 2005-08-08
CID: 22012

6904. Butaxamine; BUTOXAMINE HYDROCHLORIDE; 5696-15-1 ...
MW:     303.824840 g/mol MF: C15H26ClNO3
IUPAC name: 2-(tert-butylamino)-1-(2,5-dimethoxyphenyl)propan-1-ol;hydro...
Create Date: 2005-08-08
CID: 21909

6905. Vidarabine; 5536-17-4; Adenine arabinoside ...
MW:     267.241320 g/mol MF: C10H13N5O4
IUPAC name: (2R,3S,4S,5R)-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolane...
Create Date: 2005-06-24
CID: 21704

6906. Flucloxacillin; FLOXACILLIN; Floxapen ...
MW:     453.871783 g/mol MF: C19H17ClFN3O5S
IUPAC name: (2S,5R,6R)-6-[[3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxaz...
Create Date: 2005-06-24
CID: 21319

6907. 5,6-Dihydroxytryptamine; 5090-36-8; 3-(2-Aminoethyl)-1H-indole-5,6-diol ...
MW:     192.214480 g/mol MF: C10H12N2O2
IUPAC name: 3-(2-aminoethyl)-1H-indole-5,6-diol
Create Date: 2005-08-08
CID: 21163

6908. BUTYRYLTHIOCHOLINE; 4555-00-4; CHEMBL139908 ...
MW:     190.326200 g/mol MF: C9H20NOS+
IUPAC name: 2-butanoylsulfanylethyl(trimethyl)azanium
Create Date: 2005-03-26
CID: 20689

6909. quinacrine mustard; NSC-3424; CHEBI:37595 ...
MW:     468.846920 g/mol MF: C23H28Cl3N3O
IUPAC name: 1-N,1-N-bis(2-chloroethyl)-4-N-(6-chloro-2-methoxyacridin-9-...
Create Date: 2005-03-26
CID: 20194

6910. Quinacrine mustard dihydrochloride; quinacrine mustard; 4213-45-0 ...
MW:     541.768800 g/mol MF: C23H30Cl5N3O
IUPAC name: 1-N,1-N-bis(2-chloroethyl)-4-N-(6-chloro-2-methoxyacridin-9-...
Create Date: 2005-08-08
CID: 20193

6911. 2',3'-Dideoxyadenosine; 4097-22-7; dideoxyadenosine ...
MW:     235.242520 g/mol MF: C10H13N5O2
IUPAC name: [(2S,5R)-5-(6-aminopurin-9-yl)oxolan-2-yl]methanol
Create Date: 2005-07-07
CID: 20039

6912. Nafenopin; Melipan; Nafenoic acid ...
MW:     310.386880 g/mol MF: C20H22O3
IUPAC name: 2-methyl-2-[4-(1,2,3,4-tetrahydronaphthalen-1-yl)phenoxy]pro...
Create Date: 2005-06-24
CID: 19592

6913. CYCLACILLIN; ciclacillin; Bastcillin ...
MW:     341.425820 g/mol MF: C15H23N3O4S
IUPAC name: (2S,5R,6R)-6-[(1-aminocyclohexanecarbonyl)amino]-3,3-dimethy...
Create Date: 2005-03-26
CID: 19003

6914. ORNIPRESSIN; Ornipressin acetate; Orpressin ...
MW:    1042.191620 g/mol MF: C45H63N13O12S2
IUPAC name: N-[5-amino-1-[(2-amino-2-oxoethyl)amino]-1-oxopentan-2-yl]-1...
Create Date: 2005-08-08
CID: 18830

6915. Butaxamine; Butaxamina; Butaxaminum ...
MW:     267.363900 g/mol MF: C15H25NO3
IUPAC name: 2-(tert-butylamino)-1-(2,5-dimethoxyphenyl)propan-1-ol
Create Date: 2005-03-26
CID: 18026

6916. Azetidine-2-carboxylic acid; 2517-04-6; 20063-89-2 ...
MW:     101.103880 g/mol MF: C4H7NO2
IUPAC name: azetidine-2-carboxylic acid
Create Date: 2005-03-26
CID: 17288

6917. Diallyl trisulfide; ALLYL TRISULFIDE; 2050-87-5 ...
MW:     178.338600 g/mol MF: C6H10S3
IUPAC name: 3-(prop-2-enyltrisulfanyl)prop-1-ene
Create Date: 2005-03-26
CID: 16315

6918. NORFENFLURAMINE; Norfenfloramine; Desethylfenfluramine ...
MW:     203.204190 g/mol MF: C10H12F3N
IUPAC name: 1-[3-(trifluoromethyl)phenyl]propan-2-amine
Create Date: 2005-03-26
CID: 15897

6919. 2'-DEOXYURIDINE; deoxyuridine; 951-78-0 ...
MW:     228.201980 g/mol MF: C9H12N2O5
IUPAC name: 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimid...
Create Date: 2005-06-24
CID: 13712

6920. 732-26-3; Voidox; Alkofen B ...
MW:     262.430200 g/mol MF: C18H30O
IUPAC name: 2,4,6-tritert-butylphenol
Create Date: 2005-03-26
CID: 12902

6921. Betaine hydrochloride; Betaine chloride; Pluchine ...
MW:     153.607280 g/mol MF: C5H12ClNO2
IUPAC name: carboxymethyl(trimethyl)azanium;chloride
Create Date: 2005-07-19
CID: 11545

6922. p-HYDROXYNOREPHEDRINE; 4-(2-Amino-1-hydroxypropyl)phenol; JAYBQRKXEFDRER-UHFFFAOYSA-N ...
MW:     167.205020 g/mol MF: C9H13NO2
IUPAC name: 4-(2-amino-1-hydroxypropyl)phenol
Create Date: 2005-03-26
CID: 11099

6923. Pyrithiamine base; PYRITHIAMINE; pyrithiamine cation ...
MW:     259.326860 g/mol MF: C14H19N4O+
IUPAC name: 2-[1-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-methylpyridi...
Create Date: 2004-09-16
CID: 10803

6924. Pyrithiamin; Pyrithiamine hydrobromide; PYRITHIAMINE ...
MW:     420.142800 g/mol MF: C14H20Br2N4O
IUPAC name: 2-[1-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-methylpyridi...
Create Date: 2005-08-08
CID: 10802

6925. Bufotenine; Bufotenin; N,N-Dimethyl-5-hydroxytryptamine ...
MW:     204.268240 g/mol MF: C12H16N2O
IUPAC name: 3-[2-(dimethylamino)ethyl]-1H-indol-5-ol
Create Date: 2005-03-26
CID: 10257

6926. 2-aminopurine; 7H-purin-2-amine; 452-06-2 ...
MW:     135.126700 g/mol MF: C5H5N5
IUPAC name: 7H-purin-2-amine
Create Date: 2005-03-27
CID: 9955

6927. trans-1,4-Bis(2-chlorobenzaminomethyl)cyclohexane dihydrochloride; NSC123019; AY-9944 ...
MW:     391.377120 g/mol MF: C22H28Cl2N2
IUPAC name: N-[(2-chlorophenyl)methyl]-1-[4-[[(2-chlorophenyl)methylamin...
Create Date: 2005-03-26
CID: 9705

6928. AY 9944; AY 9944 dihydrochloride; Shh Signaling Antagonist IV ...
MW:     464.299000 g/mol MF: C22H30Cl4N2
IUPAC name: N-[(2-chlorophenyl)methyl]-1-[4-[[(2-chlorophenyl)methylamin...
Create Date: 2005-08-08
CID: 9704

6929. 342-69-8; 6-Methylthiopurine riboside; 6-Methyl MP-riboside ...
MW:     298.318260 g/mol MF: C11H14N4O4S
IUPAC name: (2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-methylsulfanylpurin-9-y...
Create Date: 2005-06-24
CID: 9570

6930. 2-deoxyglucose; 2-Desoxy-D-glucose; 2-DG ...
MW:     164.156480 g/mol MF: C6H12O5
IUPAC name: (2S,4R,5S,6R)-6-(hydroxymethyl)oxane-2,4,5-triol
Create Date: 2005-08-01
CID: 9062

6931. 2-Chloroadenosine; 146-77-0; 6-Amino-2-chloropurine riboside ...
MW:     301.686380 g/mol MF: C10H12ClN5O4
IUPAC name: (2R,3R,4S,5R)-2-(6-amino-2-chloropurin-9-yl)-5-(hydroxymethy...
Create Date: 2005-06-29
CID: 8974

6932. 3-O-Methyl-d-glucose; 3-Methylglucose; 3-methyl-D-glucose ...
MW:     194.182460 g/mol MF: C7H14O6
IUPAC name: (2R,3S,4R,5R)-2,4,5,6-tetrahydroxy-3-methoxyhexanal
Create Date: 2005-08-08
CID: 8973

6933. OXYTHIAMINE; UNII-1MF36SYZ22; 1MF36SYZ22 ...
MW:     266.339340 g/mol MF: C12H16N3O2S+
IUPAC name: 5-[[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium-3-yl]methy...
Create Date: 2005-03-26
CID: 8682

6934. Hydroxythiamine; OXYTHIAMINE; 4-Hydroxythiamine ...
MW:     301.792340 g/mol MF: C12H16ClN3O2S
IUPAC name: 5-[[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium-3-yl]methy...
Create Date: 2005-08-08
CID: 8681

6935. Isoprenaline sulphate; Isoprenaline sulfate; Aleudrin ...
MW:     520.593640 g/mol MF: C22H36N2O10S
IUPAC name: 4-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzene-1,2-diol;sulf...
Create Date: 2005-08-08
CID: 8239

6936. 3-PYRIDINEMETHANOL; 100-55-0; pyridin-3-ylmethanol ...
MW:     109.125880 g/mol MF: C6H7NO
IUPAC name: pyridin-3-ylmethanol
Create Date: 2005-03-26
CID: 7510

6937. Fucostanol; Stigmastan-3-ol; STIGMASTANOL ...
MW:     416.722580 g/mol MF: C29H52O
IUPAC name: 17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,5,6,7,...
Create Date: 2005-03-27
CID: 6743

6938. TRIPARANOL; Metasqualene; MER 29 ...
MW:     438.001480 g/mol MF: C27H32ClNO2
IUPAC name: 2-(4-chlorophenyl)-1-[4-[2-(diethylamino)ethoxy]phenyl]-1-(4...
Create Date: 2005-03-26
CID: 6536

6939. Trifluridine; TRIFLUOROTHYMIDINE; Viroptic ...
MW:     296.199950 g/mol MF: C10H11F3N2O5
IUPAC name: 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(tri...
Create Date: 2005-06-24
CID: 6256

6940. D-cycloserine; cycloserine; 68-41-7 ...
MW:     102.091940 g/mol MF: C3H6N2O2
IUPAC name: (4R)-4-amino-1,2-oxazolidin-3-one
Create Date: 2005-06-01
CID: 6234

6941. CHOLINE CHLORIDE; 67-48-1; Hepacholine ...
MW:     139.623760 g/mol MF: C5H14ClNO
IUPAC name: 2-hydroxyethyl(trimethyl)azanium;chloride
Create Date: 2005-07-19
CID: 6209

6942. Octopressin; FELYPRESSIN; Phelypressin ...
MW:    1040.218800 g/mol MF: C46H65N13O11S2
IUPAC name: N-[6-amino-1-[(2-amino-2-oxoethyl)amino]-1-oxohexan-2-yl]-1-...
Create Date: 2005-08-08
CID: 5956

6943. idoxuridine; 5-Iodo-2'-deoxyuridine; 54-42-2 ...
MW:     354.098510 g/mol MF: C9H11IN2O5
IUPAC name: 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-iodo...
Create Date: 2005-06-24
CID: 5905

6944. Isoprenaline hydrochloride; ISOPROTERENOL HYDROCHLORIDE; 51-30-9 ...
MW:     247.718520 g/mol MF: C11H18ClNO3
IUPAC name: 4-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzene-1,2-diol;hydr...
Create Date: 2005-06-24
CID: 5807

6945. 5-Bromouracil; 51-20-7; BROMOURACIL ...
MW:     190.982820 g/mol MF: C4H3BrN2O2
IUPAC name: 5-bromo-1H-pyrimidine-2,4-dione
Create Date: 2005-03-26
CID: 5802

6946. xanthurenic acid; 4,8-Dihydroxyquinoline-2-carboxylic acid; 59-00-7 ...
MW:     205.166880 g/mol MF: C10H7NO4
IUPAC name: 8-hydroxy-4-oxo-1H-quinoline-2-carboxylic acid
Create Date: 2005-03-25
CID: 5699

6947. Pirinixic acid; 50892-23-4; WY-14643 ...
MW:     323.797860 g/mol MF: C14H14ClN3O2S
IUPAC name: 2-[4-chloro-6-(2,3-dimethylanilino)pyrimidin-2-yl]sulfanylac...
Create Date: 2004-09-16
CID: 5694

6948. vigabatrin; 4-aminohex-5-enoic acid; Sabril ...
MW:     129.157040 g/mol MF: C6H11NO2
IUPAC name: 4-aminohex-5-enoic acid
Create Date: 2005-03-25
CID: 5665

6949. 5-trans U-46619; 7-[6-(3-hydroxyoct-1-en-1-yl)-2-oxabicyclo[2.2.1]hept-5-yl]hept-5-enoic acid; U-46619 ...
MW:     350.492260 g/mol MF: C21H34O4
IUPAC name: 7-[3-(3-hydroxyoct-1-enyl)-5-oxabicyclo[2.2.1]heptan-2-yl]he...
Create Date: 2005-03-25
CID: 5618

6950. triclosan; 5-CHLORO-2-(2,4-DICHLOROPHENOXY)PHENOL; 3380-34-5 ...
MW:     289.541780 g/mol MF: C12H7Cl3O2
IUPAC name: 5-chloro-2-(2,4-dichlorophenoxy)phenol
Create Date: 2005-03-25
CID: 5564

6951. spiperone; Spiroperidol; Spiropitan ...
MW:     395.469843 g/mol MF: C23H26FN3O2
IUPAC name: 8-[4-(4-fluorophenyl)-4-oxobutyl]-1-phenyl-1,3,8-triazaspiro...
Create Date: 2005-03-25
CID: 5265

6952. Asarinin; DESAMIN; PSEUDO CUBEBIN ...
MW:     354.353320 g/mol MF: C20H18O6
IUPAC name: 5-[3-(1,3-benzodioxol-5-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-...
Create Date: 2005-03-25
CID: 5204

6953. 1-pentofuranosyl-1h-1,2,4-triazole-3-carboxamide; ICN 1229; IN1124 ...
MW:     244.204680 g/mol MF: C8H12N4O5
IUPAC name: 1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2,4-triazol...
Create Date: 2005-03-25
CID: 5064

6954. Pyricarbate; pyridinol carbamate; Parmidine ...
MW:     253.254500 g/mol MF: C11H15N3O4
IUPAC name: [6-(methylcarbamoyloxymethyl)pyridin-2-yl]methyl N-methylcar...
Create Date: 2005-03-25
CID: 4990

6955. PROPIDIUM; CHEMBL332935; CHEBI:51246 ...
MW:     414.585660 g/mol MF: C27H34N4+2
IUPAC name: 3-(3,8-diamino-6-phenylphenanthridin-5-ium-5-yl)propyl-dieth...
Create Date: 2005-03-25
CID: 4939

6956. probucol; Lorelco; Biphenabid ...
MW:     516.841620 g/mol MF: C31H48O2S2
IUPAC name: 2,6-ditert-butyl-4-[2-(3,5-ditert-butyl-4-hydroxyphenyl)sulf...
Create Date: 2005-03-25
CID: 4912

6957. oxidopamine; 6-HYDROXYDOPAMINE; Hydroxydopamine ...
MW:     169.177840 g/mol MF: C8H11NO3
IUPAC name: 5-(2-aminoethyl)benzene-1,2,4-triol
Create Date: 2005-03-25
CID: 4624

6958. niceritrol; Perycit; Cardiolipol ...
MW:     556.522860 g/mol MF: C29H24N4O8
IUPAC name: [3-(pyridine-3-carbonyloxy)-2,2-bis(pyridine-3-carbonyloxyme...
Create Date: 2005-03-25
CID: 4476

6959. metyrapone; Metopirone; Metopiron ...
MW:     226.273760 g/mol MF: C14H14N2O
IUPAC name: 2-methyl-1,2-dipyridin-3-ylpropan-1-one
Create Date: 2004-09-16
CID: 4174

6960. isoproterenol; Isoprenaline; Norisodrine ...
MW:     211.257580 g/mol MF: C11H17NO3
IUPAC name: 4-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzene-1,2-diol
Create Date: 2005-03-25
CID: 3779

6961. isoniazid; Isonicotinic acid hydrazide; Isonicotinohydrazide ...
MW:     137.139280 g/mol MF: C6H7N3O
IUPAC name: pyridine-4-carbohydrazide
Create Date: 2004-09-16
CID: 3767

6962. iofetamine; Iofetamine (123I); 75917-92-9 ...
MW:     303.182490 g/mol MF: C12H18IN
IUPAC name: 1-(4-iodophenyl)-N-propan-2-ylpropan-2-amine
Create Date: 2005-03-25
CID: 3729

6963. Iododeoxyuridine; MLS002702846; CHEMBL268690 ...
MW:     354.098510 g/mol MF: C9H11IN2O5
IUPAC name: 1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-iodopyrimidine-...
Create Date: 2005-03-25
CID: 3687

6964. gemfibrozil; 25812-30-0; Lopid ...
MW:     250.333380 g/mol MF: C15H22O3
IUPAC name: 5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoic acid
Create Date: 2005-03-25
CID: 3463

6965. ganciclovir; 82410-32-0; Cytovene ...
MW:     255.230620 g/mol MF: C9H13N5O4
IUPAC name: 2-amino-9-(1,3-dihydroxypropan-2-yloxymethyl)-3H-purin-6-one
Create Date: 2005-03-25
CID: 3454

6966. fluvastatin; AC1L1FUW; CHEMBL2140067 ...
MW:     411.465943 g/mol MF: C24H26FNO4
IUPAC name: 7-[3-(4-fluorophenyl)-1-propan-2-ylindol-2-yl]-3,5-dihydroxy...
Create Date: 2005-03-25
CID: 3403

6967. 49562-28-9; Lipanthyl; Procetofen ...
MW:     360.831340 g/mol MF: C20H21ClO4
IUPAC name: propan-2-yl 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoat...
Create Date: 2005-03-25
CID: 3339

6968. para-Chloroamphetamine; p-CHLOROAMPHETAMINE; p-Chloramphetamine ...
MW:     169.651280 g/mol MF: C9H12ClN
IUPAC name: 1-(4-chlorophenyl)propan-2-amine
Create Date: 2005-03-25
CID: 3127

6969. Inosine,2',3'-dideoxy-; MLS003373937; C10H12N4O3 ...
MW:     236.227280 g/mol MF: C10H12N4O3
IUPAC name: 9-[5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one
Create Date: 2005-03-25
CID: 3043

6970. Levomethorphan; CHEMBL22207; RACEMETHORPHAN ...
MW:     271.397200 g/mol MF: C18H25NO
Create Date: 2005-03-25
CID: 3008

6971. clofibric acid; 882-09-7; 2-(4-Chlorophenoxy)-2-methylpropanoic acid ...
MW:     214.645540 g/mol MF: C10H11ClO3
IUPAC name: 2-(4-chlorophenoxy)-2-methylpropanoic acid
Create Date: 2005-03-25
CID: 2797

6972. clindamycin; STK177246; N-{2-chloro-1-[3,4,5-trihydroxy-6-(methylsulfanyl)oxan-2-yl]propyl}-1-methyl-4-propylpyrrolidine-2-carboxamide ...
MW:     424.983020 g/mol MF: C18H33ClN2O5S
IUPAC name: N-[2-chloro-1-(3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl)pr...
Create Date: 2005-03-25
CID: 2786

6973. 52214-84-3; 2-(4-(2,2-dichlorocyclopropyl)phenoxy)-2-methylpropanoic acid; Lipanor ...
MW:     289.154460 g/mol MF: C13H14Cl2O3
IUPAC name: 2-[4-(2,2-dichlorocyclopropyl)phenoxy]-2-methylpropanoic aci...
Create Date: 2005-03-25
CID: 2763

6974. betahistine; 5638-76-6; 2-(2-METHYLAMINOETHYL)PYRIDINE ...
MW:     136.194280 g/mol MF: C8H12N2
IUPAC name: N-methyl-2-pyridin-2-ylethanamine
Create Date: 2005-03-25
CID: 2366

6975. benfluorex; Benfluramate; Minolip ...
MW:     351.362810 g/mol MF: C19H20F3NO2
IUPAC name: 2-[1-[3-(trifluoromethyl)phenyl]propan-2-ylamino]ethyl benzo...
Create Date: 2005-03-25
CID: 2318

6976. allopurinol; 315-30-0; 1H-Pyrazolo[3,4-d]pyrimidin-4-ol ...
MW:     136.111460 g/mol MF: C5H4N4O
IUPAC name: 1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one
Create Date: 2005-03-25
CID: 2094

6977. acyclovir; Acycloguanosine; Aciclovir ...
MW:     225.204640 g/mol MF: C8H11N5O3
IUPAC name: 2-amino-9-(2-hydroxyethoxymethyl)-3H-purin-6-one
Create Date: 2005-03-25
CID: 2022

6978. GTPgammaS; 108964-33-6; GTP[S] ...
MW:     539.246026 g/mol MF: C10H16N5O13P3S
IUPAC name: [[5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]m...
Create Date: 2005-03-25
CID: 1764

6979. 4'-Chlorodiazepam; Ro 5-4864; 4-Chlorodiazepam ...
MW:     319.185280 g/mol MF: C16H12Cl2N2O
IUPAC name: 7-chloro-5-(4-chlorophenyl)-1-methyl-3H-1,4-benzodiazepin-2-...
Create Date: 2005-03-25
CID: 1688

6980. MEGLUTOL; 3-Hydroxy-3-methylglutaric acid; 3-Hydroxy-3-methylpentanedioic acid ...
MW:     162.140600 g/mol MF: C6H10O5
IUPAC name: 3-hydroxy-3-methylpentanedioic acid
Create Date: 2004-09-16
CID: 1662

6981. MDMA; 3,4-methylenedioxymethamphetamine; Ecstasy ...
MW:     193.242300 g/mol MF: C11H15NO2
IUPAC name: 1-(1,3-benzodioxol-5-yl)-N-methylpropan-2-amine
Create Date: 2004-09-16
CID: 1615

6982. 12-Hete; 12(S)-hydroxy-eicosatetraenoic acid; 59985-28-3 ...
MW:     320.466280 g/mol MF: C20H32O3
IUPAC name: 12-hydroxyicosa-5,8,10,14-tetraenoic acid
Create Date: 2005-03-25
CID: 1413

6983. Gallopamil; 16662-47-8; methoxyverapamil ...
MW:     484.627600 g/mol MF: C28H40N2O5
IUPAC name: 5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-propan-2-yl-2...
Create Date: 2005-03-25
CID: 1234

6984. 145-13-1; C21H32O2; 3-Hydroxypregn-5-en-20-one ...
MW:     316.477580 g/mol MF: C21H32O2
IUPAC name: 1-(3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-do...
Create Date: 2005-03-25
CID: 1027

6985. nicotinic acid; niacin; Pyridine-3-carboxylic acid ...
MW:     123.109400 g/mol MF: C6H5NO2
IUPAC name: pyridine-3-carboxylic acid
Create Date: 2004-09-16
CID: 938

6986. nicotinate; pyridine-3-carboxylate; nicotinat ...
MW:     122.101460 g/mol MF: C6H4NO2-
IUPAC name: pyridine-3-carboxylate
Create Date: 2004-09-16
CID: 937

6987. choline sulfate; 2-(trimethylammonio)ethyl sulfate; choline sulfate betaine ...
MW:     183.226020 g/mol MF: C5H13NO4S
IUPAC name: 2-(trimethylazaniumyl)ethyl sulfate
Create Date: 2004-09-16
CID: 485

6988. choline; Choline ion; Bilineurine ...
MW:     104.170760 g/mol MF: C5H14NO+
IUPAC name: 2-hydroxyethyl(trimethyl)azanium
Create Date: 2004-09-16
CID: 305

6989. carbon monoxide; carbon monooxide; Carbonic oxide ...
MW:      28.010100 g/mol MF: CO
IUPAC name: carbon monoxide
Create Date: 2004-09-16
CID: 281

6990. TRIMETHYL GLYCINE; Cystadane; Betaine hydrochloride ...
MW:     118.154280 g/mol MF: C5H12NO2+
IUPAC name: carboxymethyl(trimethyl)azanium
Create Date: 2004-09-16
CID: 248

6991. betaine; oxyneurine; glycine betaine ...
MW:     117.146340 g/mol MF: C5H11NO2
IUPAC name: 2-(trimethylazaniumyl)acetate
Create Date: 2004-09-16
CID: 247

6992. 2-Deoxyhexopyranose; MLS002638629; Glucose, 2-deoxy- ...
MW:     164.156480 g/mol MF: C6H12O5
IUPAC name: 6-(hydroxymethyl)oxane-2,4,5-triol
Create Date: 2005-03-25
CID: 40
