CFam Chemical Families Database
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You are searching for "CFAMM00417568" in compound.

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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 CFAMM00417568
Family CFFBM12661 Cannabinoid receptor 2 and Cannabinoid receptor 1 ligand N-[[4-(diethylamino)phenyl]methyl]-4-methyl-N-(4-methylphenyl)benzenesulfonamide family
Superfamily CFSBM1660 D(2) dopamine receptor and D(3) dopamine receptor Binder Superfamily 16
Class CFCAD151 Class 151
External ID CHEMBL427727 External Source CHEMBL
PubChem CID 44237029 Functional Category Bioactive
Molecule Name arylsulfonylpiperazine, 28
IUPAC Name 1-(4-tert-butylphenyl)sulfonyl-4-[2-(trifluoromethyl)phenyl]piperazine
Synonyms AGN-PC-0736HW;1-(4-tert-butylphenyl)sulfonyl-4-[2-(trifluoromethyl)phenyl]piperazine
InChi InChI=1S/C21H25F3N2O2S/c1-20(2,3)16-8-10-17(11-9-16)29(27,28)26-14-12-25(13-15-26)19-7-5-4-6-18(19)21(22,23)24/h4-11H,12-15H2,1-3H3
InChiKey TYRFFCXDCSRBCY-UHFFFAOYSA-N
Formula C21H25F3N2O2S Molecular Weight 426.50
Cross Link CHEMBL427727
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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