CFam Chemical Families Database
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You are searching for "CFAMM00418952" 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 CFAMM00418952
Family CFFBM12915 Thyroid hormone receptor beta and Thyroid hormone receptor alpha ligand 1r6g family
Superfamily CFSBM3995 Thyroid hormone receptor beta and Thyroid hormone receptor alpha Binder Superfamily 4
Class CFCID648 Class 1998
External ID CHEMBL391945 External Source CHEMBL
PubChem CID 44434604 Functional Category Bioactive
Molecule Name 2-[4-[3-(benzoylcarbamoyl)-4-hydroxyphenoxy]-3,5-dibromophenyl]acetic acid
IUPAC Name 2-[4-[3-(benzoylcarbamoyl)-4-hydroxyphenoxy]-3,5-dibromophenyl]acetic acid
Synonyms AGN-PC-076BQ5;2-[4-[3-(benzoylcarbamoyl)-4-hydroxyphenoxy]-3,5-dibromophenyl]acetic acid
InChi InChI=1S/C22H15Br2NO6/c23-16-8-12(10-19(27)28)9-17(24)20(16)31-14-6-7-18(26)15(11-14)22(30)25-21(29)13-4-2-1-3-5-13/h1-9,11,26H,10H2,(H,27,28)(H,25,29,30)
InChiKey LJITWXWEDRDUFO-UHFFFAOYSA-N
Formula C22H15Br2NO6 Molecular Weight 549.17
Cross Link CHEMBL391945
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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