CFam Chemical Families Database
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You are searching for "CFAMM00445389" in compound.

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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 CFAMM00445389
Family CFFBM18004 Cannabinoid receptor 1 ligand AGN-PC-077JWI family
Superfamily CFSCD39 Transient receptor potential cation channel subfamily V member 1 Ligand Bctc Superfamily
Class CFCCD33 Class 846
External ID CHEMBL498783 External Source CHEMBL
PubChem CID 44576715 Functional Category Bioactive
Molecule Name AGN-PC-077JX5
IUPAC Name 1-[6-(2-chloropyridin-4-yl)-5-[4-(trifluoromethyl)phenyl]pyrazin-2-yl]-3-(ethylamino)azetidine-3-carboxamide
Synonyms CHEBI:586392;1-[6-(2-chloropyridin-4-yl)-5-[4-(trifluoromethyl)phenyl]pyrazin-2-yl]-3-(ethylamino)azetidine-3-carboxamide
InChi InChI=1S/C22H20ClF3N6O/c1-2-30-21(20(27)33)11-32(12-21)17-10-29-18(13-3-5-15(6-4-13)22(24,25)26)19(31-17)14-7-8-28-16(23)9-14/h3-10,30H,2,11-12H2,1H3,(H2,27,33)
InChiKey YSPBHPREQBXDKT-UHFFFAOYSA-N
Formula C22H20ClF3N6O Molecular Weight 476.88
Cross Link CHEMBL498783
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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