CFam Chemical Families Database
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You are searching for "CFAMM00400237" in compound.

Total 1 results found.

Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00400237
Family CFFBM10186 Cannabinoid receptor 1 ligand SureCN4819820 family
Superfamily CFSAD222 Cannabinoid receptor 1 Ligand Rimonabant Superfamily
Class CFCAD213 Class 213
External ID CHEMBL201602 External Source CHEMBL
PubChem CID 11374417 Functional Category Bioactive
Molecule Name AGN-PC-007TSJ
IUPAC Name 2-(2-chlorophenyl)-3-(4-chlorophenyl)-5-methyl-6-(2,2,2-trifluoroethyl)pyrazolo[4,3-d]pyrimidin-7-one
Synonyms SureCN4813964;pyrazolopyrimidinone-based antagonist, 3;2-(2-chlorophenyl)-3-(4-chlorophenyl)-5-methyl-6-(2,2,2-trifluoroethyl)pyrazolo[4,3-d]pyrimidin-7-one
InChi InChI=1S/C20H13Cl2F3N4O/c1-11-26-16-17(19(30)28(11)10-20(23,24)25)27-29(15-5-3-2-4-14(15)22)18(16)12-6-8-13(21)9-7-12/h2-9H,10H2,1H3
InChiKey IXMNBHPNQQLFMV-UHFFFAOYSA-N
Formula C20H13Cl2F3N4O Molecular Weight 453.24
Cross Link CHEMBL201602
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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