CFam Chemical Families Database
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You are searching for "CFAMM00282517" in compound.

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CFAM Mol ID CFAMM00282517
Family CFFID3030 Kappa-type opioid receptor and Mu-type opioid receptor Ligand 2-(2-methylquinolin-4-ylamino)-n-phenylacetamide Family
Superfamily CFSID2125 Kappa-type opioid receptor and Mu-type opioid receptor Ligand 2-(2-methylquinolin-4-ylamino)-n-phenylacetamide Superfamily
Class CFCCD292 Class 1105
External ID CHEMBL1631543 External Source CHEMBL
PubChem CID 49850770 Functional Category Bioactive
Molecule Name AGN-PC-088O4M
IUPAC Name 3-[3-[2-[4-(2-methylquinolin-5-yl)piperazin-1-yl]ethyl]phenyl]-1,3-oxazinan-2-one
Synonyms 3-[3-[2-[4-(2-methylquinolin-5-yl)piperazin-1-yl]ethyl]phenyl]-1,3-oxazinan-2-one
InChi InChI=1S/C26H30N4O2/c1-20-9-10-23-24(27-20)7-3-8-25(23)29-16-14-28(15-17-29)13-11-21-5-2-6-22(19-21)30-12-4-18-32-26(30)31/h2-3,5-10,19H,4,11-18H2,1H3
InChiKey DSVNWBCSOKKCGQ-UHFFFAOYSA-N
Formula C26H30N4O2 Molecular Weight 430.54
Cross Link CHEMBL1631543
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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