CFam Chemical Families Database
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You are searching for "CFAMM00143518" in compound.

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CFAM Mol ID CFAMM00143518
Family CFFCD214 Melatonin receptor type 1A Ligand Agomelatine Family
Superfamily CFSCD193 Melatonin receptor type 1A Ligand Agomelatine Superfamily
Class CFCCD153 Class 966
External ID CHEMBL491605 External Source CHEMBL
PubChem CID 44579260 Functional Category Bioactive
Molecule Name AGN-PC-077LKU
IUPAC Name methyl 3-[4-(2-acetamidoethyl)-6-methoxynaphthalen-2-yl]benzoate
Synonyms CHEBI:591256;methyl 3-[4-(2-acetamidoethyl)-6-methoxynaphthalen-2-yl]benzoate
InChi InChI=1S/C23H23NO4/c1-15(25)24-10-9-18-13-20(12-17-7-8-21(27-2)14-22(17)18)16-5-4-6-19(11-16)23(26)28-3/h4-8,11-14H,9-10H2,1-3H3,(H,24,25)
InChiKey VADTZBHHWHUOCA-UHFFFAOYSA-N
Formula C23H23NO4 Molecular Weight 377.43
Cross Link CHEMBL491605
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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