CFam Chemical Families Database
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You are searching for "CFAMM00044288" in compound.

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CFAM Mol ID CFAMM00044288
Family CFFAD251 Cannabinoid receptor 1 Ligand Rimonabant Family
Superfamily CFSAD222 Cannabinoid receptor 1 Ligand Rimonabant Superfamily
Class CFCAD213 Class 213
External ID CHEMBL592287 External Source CHEMBL
PubChem CID 46225235 Functional Category Bioactive
Molecule Name AGN-PC-07R5ZX
IUPAC Name 2-[1-(2-chlorophenyl)-5-(4-chlorophenyl)-3-[2-(4-fluorophenyl)pyrrolidine-1-carbonyl]pyrazol-4-yl]acetonitrile
Synonyms CHEBI:691084;2-[1-(2-chlorophenyl)-5-(4-chlorophenyl)-3-[2-(4-fluorophenyl)pyrrolidine-1-carbonyl]pyrazol-4-yl]acetonitrile
InChi InChI=1S/C28H21Cl2FN4O/c29-20-11-7-19(8-12-20)27-22(15-16-32)26(33-35(27)25-5-2-1-4-23(25)30)28(36)34-17-3-6-24(34)18-9-13-21(31)14-10-18/h1-2,4-5,7-14,24H,3,6,15,17H2
InChiKey JNYPFLGHBZFJQG-UHFFFAOYSA-N
Formula C28H21Cl2FN4O Molecular Weight 519.40
Cross Link CHEMBL592287
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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