CFam Chemical Families Database
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You are searching for "CFAMM00243216" in compound.

Total 1 results found.

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 CFAMM00243216
Family CFFID1566 Substance-K receptor Ligand MEN-14933 Family
Superfamily CFSID1220 Substance-K receptor Ligand MEN-14933 Superfamily
Class CFCCD537 Class 1350
External ID CHEMBL448198 External Source CHEMBL
PubChem CID 44586483 Functional Category Bioactive
Molecule Name methyl 2-[3-[3-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-hydroxypropyl]-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]propanoate
IUPAC Name methyl 2-[3-[3-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-hydroxypropyl]-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]propanoate
Synonyms AGN-PC-077PVT;methyl 2-[3-[3-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-hydroxypropyl]-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]propanoate
InChi InChI=1S/C34H40N4O6/c1-4-44-30-18-12-11-17-29(30)36-21-19-35(20-22-36)23-28(39)24-37-33(42)38(25(2)31(40)43-3)32(41)34(37,26-13-7-5-8-14-26)27-15-9-6-10-16-27/h5-18,25,28,39H,4,19-24H2,1-3H3
InChiKey YVSNFTJWRKZTPD-UHFFFAOYSA-N
Formula C34H40N4O6 Molecular Weight 600.70
Cross Link CHEMBL448198
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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