CFam Chemical Families Database
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You are searching for "CFAMM00448461" 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 CFAMM00448461
Family CFFBM18637 Metabotropic glutamate receptor 1 ligand AGN-PC-07CPMZ family
Superfamily CFSCD463 Substance-P receptor Ligand TAK-637 Superfamily
Class CFCCD27 Class 840
External ID CHEMBL565943 External Source CHEMBL
PubChem CID 45484935 Functional Category Bioactive
Molecule Name AGN-PC-07CPMZ
IUPAC Name 2-cyclopropyl-5-(5-methyl-1-pyridin-3-yltriazol-4-yl)-2,3-dihydroinden-1-one
Synonyms CHEBI:676600;2-cyclopropyl-5-(5-methyl-1-pyridin-3-yltriazol-4-yl)-2,3-dihydroinden-1-one
InChi InChI=1S/C20H18N4O/c1-12-19(22-23-24(12)16-3-2-8-21-11-16)14-6-7-17-15(9-14)10-18(20(17)25)13-4-5-13/h2-3,6-9,11,13,18H,4-5,10H2,1H3
InChiKey GTXLGPGRDMYOHC-UHFFFAOYSA-N
Formula C20H18N4O Molecular Weight 330.38
Cross Link CHEMBL565943
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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