CFam Chemical Families Database
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You are searching for "CFAMM00421493" in compound.

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CFAM Mol ID CFAMM00421493
Family CFFBM13274 Vascular endothelial growth factor receptor 2 ligand N-(4-chlorophenyl)-6-(6,7-dimethoxyquinolin-4-yl)oxy-5-fluoronaphthalene-1-carboxamide family
Superfamily CFSBM308 Vasopressin V2 receptor and Vasopressin V1a receptor Binder Superfamily 2
Class CFCBM120 Class 3170
External ID CHEMBL493253 External Source CHEMBL
PubChem CID 24960310 Functional Category Bioactive
Molecule Name AGN-PC-04UPAX
IUPAC Name N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(6,7-dimethoxyquinolin-4-yl)methyl]-3,4-dihydro-1H-isoquinoline-5-carboxamide
Synonyms SureCN9605584;CHEBI:568578;N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(6,7-dimethoxyquinolin-4-yl)methyl]-3,4-dihydro-1H-isoquinoline-5-carboxamide
InChi InChI=1S/C29H25ClF3N3O3/c1-38-26-13-22-18(8-10-34-25(22)14-27(26)39-2)16-36-11-9-20-17(15-36)4-3-5-21(20)28(37)35-19-6-7-24(30)23(12-19)29(31,32)33/h3-8,10,12-14H,9,11,15-16H2,1-2H3,(H,35,37)
InChiKey VGQWJXMBZPYZDF-UHFFFAOYSA-N
Formula C29H25ClF3N3O3 Molecular Weight 555.98
Cross Link CHEMBL493253
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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