CFam Chemical Families Database
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You are searching for "CFAMM00044154" in compound.

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CFAM Mol ID CFAMM00044154
Family CFFAD251 Cannabinoid receptor 1 Ligand Rimonabant Family
Superfamily CFSAD222 Cannabinoid receptor 1 Ligand Rimonabant Superfamily
Class CFCAD213 Class 213
External ID CHEMBL1788112 External Source CHEMBL
PubChem CID 54585418 Functional Category Bioactive
Molecule Name [3H]RIMONABANT
IUPAC Name 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-N-piperidin-1-yl-4-(tritritiomethyl)pyrazole-3-carboxamide
Synonyms [3H]-rimonabant;GTPL745;[3H]-SR141716
InChi InChI=1S/C22H21Cl3N4O/c1-14-20(22(30)27-28-11-3-2-4-12-28)26-29(19-10-9-17(24)13-18(19)25)21(14)15-5-7-16(23)8-6-15/h5-10,13H,2-4,11-12H2,1H3,(H,27,30)/i1T3
InChiKey JZCPYUJPEARBJL-RLXJOQACSA-N
Formula C22H18Cl3N4OT3 Molecular Weight 469.76
Cross Link CHEMBL1788112
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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