CFam Chemical Families Database
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You are searching for "CFAMM00439014" in compound.

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CFAM Mol ID CFAMM00439014
Family CFFBM16675 Vascular endothelial growth factor receptor 2 ligand 2-aminobenzimidazole, 13 family
Superfamily CFSBM86 Vascular endothelial growth factor receptor 2 and Dual specificity mitogen-activated protein kinase kinase 1 Binder Superfamily
Class CFCAD481 Class 481
External ID CHEMBL427837 External Source CHEMBL
PubChem CID 11307497 Functional Category Bioactive
Molecule Name 2-aminobenzimidazole, 14
IUPAC Name N-[4-chloro-3-[(4-methylpiperazin-1-yl)methyl]phenyl]-6-(6,7-dimethoxyquinolin-4-yl)oxy-1H-benzimidazol-2-amine
Synonyms AGN-PC-006GLR;SureCN4363207;N-[4-chloro-3-[(4-methylpiperazin-1-yl)methyl]phenyl]-6-(6,7-dimethoxyquinolin-4-yl)oxy-1H-benzimidazol-2-amine
InChi InChI=1S/C30H31ClN6O3/c1-36-10-12-37(13-11-36)18-19-14-20(4-6-23(19)31)33-30-34-24-7-5-21(15-26(24)35-30)40-27-8-9-32-25-17-29(39-3)28(38-2)16-22(25)27/h4-9,14-17H,10-13,18H2,1-3H3,(H2,33,34,35)
InChiKey GZXULZRBYRVYLK-UHFFFAOYSA-N
Formula C30H31ClN6O3 Molecular Weight 559.06
Cross Link CHEMBL427837
Structure

Statistics of CFAM Database

 
CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.
 

How to cite our database

 
C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).
 

Last update by

 
2014.08.29
 

 

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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