CFam Chemical Families Database
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You are searching for "CFAMM00434546" 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 CFAMM00434546
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 CHEMBL312046 External Source CHEMBL
PubChem CID 14783739 Functional Category Bioactive
Molecule Name AGN-PC-002JDP
IUPAC Name 1-(4-azidophenyl)-8-[1-(4-chlorophenyl)ethyl]-1,3,8-triazaspiro[4.5]decan-4-one
Synonyms CHEBI:231332;1-(4-azidophenyl)-8-[1-(4-chlorophenyl)ethyl]-1,3,8-triazaspiro[4.5]decan-4-one
InChi InChI=1S/C21H23ClN6O/c1-15(16-2-4-17(22)5-3-16)27-12-10-21(11-13-27)20(29)24-14-28(21)19-8-6-18(7-9-19)25-26-23/h2-9,15H,10-14H2,1H3,(H,24,29)
InChiKey DVABHJQRZOXTRV-UHFFFAOYSA-N
Formula C21H23ClN6O Molecular Weight 410.90
Cross Link CHEMBL312046
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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