CFam Chemical Families Database
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You are searching for "CFAMM00415377" in compound.

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CFAM Mol ID CFAMM00415377
Family CFFBM12381 Peroxisome proliferator-activated receptor delta ligand SureCN394392 family
Superfamily CFSBM5747 Peroxisome proliferator-activated receptor delta Binder Superfamily
Class CFCBM1548 Class 4598
External ID CHEMBL390004 External Source CHEMBL
PubChem CID 44425864 Functional Category Bioactive
Molecule Name SureCN3697245
IUPAC Name 2-[2-methyl-4-[2-methyl-3-[4-(trifluoromethyl)phenoxy]propyl]sulfanylphenoxy]acetic acid
Synonyms AGN-PC-07666C;CHEBI:484196;2-[2-methyl-4-[2-methyl-3-[4-(trifluoromethyl)phenoxy]propyl]sulfanylphenoxy]acetic acid
InChi InChI=1S/C20H21F3O4S/c1-13(10-26-16-5-3-15(4-6-16)20(21,22)23)12-28-17-7-8-18(14(2)9-17)27-11-19(24)25/h3-9,13H,10-12H2,1-2H3,(H,24,25)
InChiKey PBXINEIAHPXNFF-UHFFFAOYSA-N
Formula C20H21F3O4S Molecular Weight 414.44
Cross Link CHEMBL390004
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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