CFam Chemical Families Database
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You are searching for "CFAMM00403829" in compound.

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CFAM Mol ID CFAMM00403829
Family CFFBM10705 Melanin-concentrating hormone receptor 1 ligand 3-[4-fluoro-3-(trifluoromethyl)phenyl]-1-[(1S,4R,5S)-1-(3-methoxyphenyl)-4-bicyclo[3.1.0]hexanyl]-1-[3-(4-methylpiperazin-1-yl)propyl]urea family
Superfamily CFSBM5244 Melanin-concentrating hormone receptor 1 Binder Superfamily 7
Class CFCBM1751 Class 4801
External ID CHEMBL204881 External Source CHEMBL
PubChem CID 11504906 Functional Category Bioactive
Molecule Name 3-[4-fluoro-3-(trifluoromethyl)phenyl]-1-[(1S,4R,5S)-1-(4-methoxyphenyl)-4-bicyclo[3.1.0]hexanyl]-1-[3-(4-methylpiperazin-1-yl)propyl]urea
IUPAC Name 3-[4-fluoro-3-(trifluoromethyl)phenyl]-1-[(1S,4R,5S)-1-(4-methoxyphenyl)-4-bicyclo[3.1.0]hexanyl]-1-[3-(4-methylpiperazin-1-yl)propyl]urea
Synonyms CHEBI:443162
InChi InChI=1S/C29H36F4N4O2/c1-35-14-16-36(17-15-35)12-3-13-37(27(38)34-21-6-9-25(30)23(18-21)29(31,32)33)26-10-11-28(19-24(26)28)20-4-7-22(39-2)8-5-20/h4-9,18,24,26H,3,10-17,19H2,1-2H3,(H,34,38)/t24-,26-,28-/m1/s1
InChiKey HJNSJDPMBGSSML-OROMBRFGSA-N
Formula C29H36F4N4O2 Molecular Weight 548.62
Cross Link CHEMBL204881
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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