CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00434547" 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 CFAMM00434547
Family CFFBM15525 Mu-type opioid receptor and Delta-type opioid receptor ligand AGN-PC-002JDN family
Superfamily CFSBM5570 Nociceptin receptor and Mu-type opioid receptor Binder Superfamily 8
Class CFCID1046 Class 2396
External ID CHEMBL312281 External Source CHEMBL
PubChem CID 14783734 Functional Category Bioactive
Molecule Name AGN-PC-002JDN
IUPAC Name 8-[1-(4-chlorophenyl)ethyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
Synonyms CHEBI:231190;LS-154763;1,3,8-Triazaspiro[4.5]decan-4-one, 8-[1-(4-chlorophenyl)ethyl]-1-phenyl-
InChi InChI=1S/C21H24ClN3O/c1-16(17-7-9-18(22)10-8-17)24-13-11-21(12-14-24)20(26)23-15-25(21)19-5-3-2-4-6-19/h2-10,16H,11-15H2,1H3,(H,23,26)
InChiKey KFEYPBZJPJJRFX-UHFFFAOYSA-N
Formula C21H24ClN3O Molecular Weight 369.89
Cross Link CHEMBL312281
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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