CFam Chemical Families Database
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You are searching for "CFAMM00439667" in compound.

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CFAM Mol ID CFAMM00439667
Family CFFBM16862 Thromboxane A2 receptor ligand 3-[3-[2-[(4-chlorophenyl)sulfonylamino]ethyl]-5-[(4-methoxyphenyl)methyl]phenyl]propanoic acid family
Superfamily CFSBM6940 Thromboxane A2 receptor ligand 3-[3-[2-[(4-chlorophenyl)sulfonylamino]ethyl]-5-[(4-methoxyphenyl)methyl]phenyl]propanoic acid Superfamily
Class CFCBM981 Class 4031
External ID CHEMBL417742 External Source CHEMBL
PubChem CID 44305347 Functional Category Bioactive
Molecule Name 3-[3-[2-[(4-chlorophenyl)sulfonylamino]ethyl]-5-[(4-methoxyphenyl)methyl]phenyl]propanoic acid
IUPAC Name 3-[3-[2-[(4-chlorophenyl)sulfonylamino]ethyl]-5-[(4-methoxyphenyl)methyl]phenyl]propanoic acid
Synonyms SureCN8595627;AGN-PC-074DF7;3-[3-[2-[(4-chlorophenyl)sulfonylamino]ethyl]-5-[(4-methoxyphenyl)methyl]phenyl]propanoic acid
InChi InChI=1S/C25H26ClNO5S/c1-32-23-7-2-18(3-8-23)14-21-16-19(4-11-25(28)29)15-20(17-21)12-13-27-33(30,31)24-9-5-22(26)6-10-24/h2-3,5-10,15-17,27H,4,11-14H2,1H3,(H,28,29)
InChiKey QKQMESPLMZGCNX-UHFFFAOYSA-N
Formula C25H26ClNO5S Molecular Weight 488.00
Cross Link CHEMBL417742
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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