CFam Chemical Families Database
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You are searching for "CFAMM00393545" in compound.

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CFAM Mol ID CFAMM00393545
Family CFFBM9185 Melanocortin receptor 4 and Melanocortin receptor 5 ligand 3-[(2R)-3-(2,4-dichlorophenyl)-1-oxo-1-[4-[2-[(2-thiophen-2-ylethylamino)methyl]phenyl]piperazin-1-yl]propan-2-yl]-1,1-dimethylurea family
Superfamily CFSBM4698 Melanocortin receptor 4 and Melanocortin receptor 5 Binder Superfamily 4
Class CFCBM282 Class 3332
External ID CHEMBL186083 External Source CHEMBL
PubChem CID 9915636 Functional Category Bioactive
Molecule Name SureCN6810288
IUPAC Name 3-amino-N-[(2R)-3-(4-chlorophenyl)-1-oxo-1-[4-[2-[(2-thiophen-2-ylethylamino)methyl]phenyl]piperazin-1-yl]propan-2-yl]propanamide
Synonyms CHEBI:410859
InChi InChI=1S/C29H36ClN5O2S/c30-24-9-7-22(8-10-24)20-26(33-28(36)11-13-31)29(37)35-17-15-34(16-18-35)27-6-2-1-4-23(27)21-32-14-12-25-5-3-19-38-25/h1-10,19,26,32H,11-18,20-21,31H2,(H,33,36)/t26-/m1/s1
InChiKey GRAFEEBFOIOLGS-AREMUKBSSA-N
Formula C29H36ClN5O2S Molecular Weight 554.15
Cross Link CHEMBL186083
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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