VINBLASTINE Next Previous

ChEMBL ID CHEMBL159
PubChem CID 13342
DrugBank Accession Number
ClinicalTrials VINBLASTINE
Molecular Formula C46H58N4O9
Inchikey JXLYSJRDGCGARV-CFWMRBGOSA-N

Smiles
CC[C@]1(O)C[C@@H]2CN(CCc3c([nH]c4ccccc34)[C@@](C2)(C(=O)OC)c5cc6c(cc5OC)N(C)[C@H]7[C@](O)([C@H](OC(=O)C)[C@]8(CC)C=CCN9CC[C@]67[C@H]89)C(=O)OC)C1

Synonyms
vinblastine, Vinblastin, Vincaleucoblastin, Vincoblastine, Rozevin, Nincaluicolflastine, Vincaleukoblastine, Vinblastina [DCIT], Vinblastina, Vinblastinum, Vincaleucoblastine, Vinblastine [INN:BAN], Vinblastinum [INN-Latin], CHEMBL159, UNII-5V9KLZ54CY, CCRIS 9002, VR-8, HSDB 3263, 1z2b, C46H58N4O9, NCI-C04842, EINECS 212-734-0, NSC 47842, AC1L21JC, 29060-LE, BIDD:PXR0201, BSPBio_001228, 865-21-4, STOCK1N-38480, NDC 0002-1452-01, LS-1859, NCGC00022585-04, (2ALPHA,2'BETA,3BETA,4ALPHA,5BETA)-VINCALEUKOBLASTINE, (2xi,3beta,4'beta,19xi)-vincaleukoblastine, (3aR-(3aalpha,4beta,5beta,5abeta,9(3R*,5S*,7R*,9S*),10bR*,13aalpha))-methyl 4-(acetyloxy)-3a-ethyl-9-(5-ethyl-1,4,5,6,7,8,9,10-octahydro-5-hydroxy-9-(methoxycarbonyl)-2H-3,7-methanoazacycloundecino(5,4-b)indol-9-yl)-3a,4,5,5a,6,11,12,13a-octahydro-5-hydroxy-8-methoxy-6-methyl-1H-indolizino(8,1-cd)carbazole-5-carboxylate, 1H-Indolizino(8,1-cd)carbazole-5-carboxylic acid, 4-(acetyloxy)-3a-ethyl-9-(5-ethyl-1,4,5,6,7,8,9,10-octahydro-5-hydroxy-9-(methoxycarbonyl)-2H-3,7-methanoazacycloundecino(5,4-b)indol-9-yl)-3a,4,5,5a,6,11,12,13a-octahydro-5-hydroxy-8-methoxy-6-methyl-, methyl ester, (3aR-(3aalpha,4beta,5beta,5abeta,9(3R*,5S*,7R*,9S*),10bR*,13aalpha))-, BRD-K01188359-065-02-5, Vinblastina (TN), Vinblastine (INN), VLB, AC1MXZJ2, Spectrum2_000890, Spectrum3_001994, Vinblastine sulphate, Neuro_000020, BSPBio_003594, NCGC00181127-01, Bio-0111, SPBio_000680, AC1L68D2, cid_5388983, KBio3_003033, HMS2090K05, Velbanreg, Velbereg, DB00570, 2'-Epivinblastine, CID13342, NCI60_004200, LS-187263, nchembio873-comp22, C07201, D08675, (2'R)-Vincaleukoblastine, SCHEMBL3628, 5V9KLZ54CY, CHEMBL607706, GTPL6851, DTXSID8021430, NChemBio.2007.10-comp22, CHEBI:171516, JXLYSJRDGCGARV-CFWMRBGOSA-N, BDBM50012278, CID241903, DAP000785, AKOS015965500, CID3823887, CID6710780, MCULE-9967454324, NCGC00022585-05, AC-20335, AC-24191, AN-47800, Q943, W-5281, 139299-EP2270008A1, 139299-EP2292617A1, (2ALPHA,2''''BETA,3BETA,4ALPHA,5BETA)-VINCALEUKOBLASTINE, 72401-36-6, Vinblastine, Velban, [3H]-Vinblastine

Compound Properties
Drug/Drug-like Properties
Known Drug
Medchem Alerts
Passes of Rule of 3
Rule of 5 Violations 2
Molecular Species NEUTRAL
Molecular Properties
Molecular Weight 810.97
Rotatable Bonds 10
Acidic pKa (ACD) 11.36
Basic pKa (ACD) 7.9
LogP (ACD) 5.92
LogD (ACD) 5.43
ALogP 4.89
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