CFam Chemical Families Database
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You are searching for "CFAMM00313225" in compound.

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CFAM Mol ID CFAMM00313225
Family CFFBM556 Vasopressin V1a receptor and Vasopressin V2 receptor ligand [4-(4-chloro-2-methylphenyl)-3-methoxyphenyl]-[(1R,5S)-3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl]methanone family
Superfamily CFSBM338 Vasopressin V2 receptor and Vasopressin V1a receptor Binder Superfamily 3
Class CFCCD80 Class 893
External ID 21839753 External Source PubChem
PubChem CID 21839753 Functional Category Patent Compound
Molecule Name AGN-PC-03GGN2
IUPAC Name 3-[1-(3,4-dichlorophenyl)but-3-enyl]-6-methoxy-2-methyl-3H-isoindol-1-one
Synonyms SureCN7496873;3-[1-(3,4-dichlorophenyl)but-3-enyl]-6-methoxy-2-methyl-3H-isoindol-1-one
InChi InChI=1S/C20H19Cl2NO2/c1-4-5-14(12-6-9-17(21)18(22)10-12)19-15-8-7-13(25-3)11-16(15)20(24)23(19)2/h4,6-11,14,19H,1,5H2,2-3H3
InChiKey DDGPQGQERODFKD-UHFFFAOYSA-N
Formula C20H19Cl2NO2 Molecular Weight 376.28
Cross Link
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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