CFam Chemical Families Database
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You are searching for "CFAMM00248496" in compound.

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CFAM Mol ID CFAMM00248496
Family CFFID1728 Thyroid hormone receptor beta Ligand (3,5-dibromo-4-pentyloxy-phenyl)-acetic Acid Family
Superfamily CFSID1331 Prostaglandin D2 receptor 2 and Thyroid hormone receptor beta Binder Superfamily
Class CFCID875 Class 2225
External ID CHEMBL289343 External Source CHEMBL
PubChem CID 10456830 Functional Category Bioactive
Molecule Name SureCN7069928
IUPAC Name 3-[3,5-dibromo-4-(4-hydroxy-3-propan-2-ylphenoxy)phenyl]propanoic acid
Synonyms dibromo phenylpropionic acid, 6;3,5-Dibromo-4-(3-Isopropyl-Phenoxy)benzoic Acid;OEF
InChi InChI=1S/C18H18Br2O4/c1-10(2)13-9-12(4-5-16(13)21)24-18-14(19)7-11(8-15(18)20)3-6-17(22)23/h4-5,7-10,21H,3,6H2,1-2H3,(H,22,23)
InChiKey DGODJDXDANWOEP-UHFFFAOYSA-N
Formula C18H18Br2O4 Molecular Weight 458.14
Cross Link CHEMBL289343
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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