CFam Chemical Families Database
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You are searching for "CFAMM00311603" 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 CFAMM00311603
Family CFFBM444 Orexin receptor type 2 and Orexin receptor type 1 ligand AGN-PC-04YYC4 family
Superfamily CFSID2435 Gamma-aminobutyric acid receptor subunit alpha-1 Ligand Ripazepam Superfamily
Class CFCCD30 Class 843
External ID CHEMBL2218442 External Source CHEMBL
PubChem CID 58157063 Functional Category Bioactive
Molecule Name AGN-PC-0C7PDL
IUPAC Name N-[(2-chloro-4-fluorophenyl)methyl]-2-[3,5-dimethyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetamide
Synonyms SureCN1194704;N-[(2-chloro-4-fluorophenyl)methyl]-2-[3,5-dimethyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetamide
InChi InChI=1S/C21H28ClFN4O/c1-15-19(13-21(28)24-14-17-6-7-18(23)12-20(17)22)16(2)27(25-15)11-10-26-8-4-3-5-9-26/h6-7,12H,3-5,8-11,13-14H2,1-2H3,(H,24,28)
InChiKey XYINRPDNNRDMAZ-UHFFFAOYSA-N
Formula C21H28ClFN4O Molecular Weight 406.92
Cross Link CHEMBL2218442
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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