CFam Chemical Families Database
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You are searching for "CFAMM00171487" in compound.

Total 1 results found.

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 CFAMM00171487
Family CFFCD781 Indeglitazar family
Superfamily CFSAD760 5-hydroxytryptamine receptor 1A Ligand Treximet Superfamily
Class CFCAD82 Class 82
External ID CHEMBL463395 External Source CHEMBL
PubChem CID 11533683 Functional Category Bioactive
Molecule Name AGN-PC-00B1VW
IUPAC Name 2-[(4-but-2-ynoxyphenyl)sulfonylamino]-3-(5-phenylmethoxy-1H-indol-3-yl)propanoic acid
Synonyms SureCN3850968;CHEBI:623149;2-[(4-but-2-ynoxyphenyl)sulfonylamino]-3-(5-phenylmethoxy-1H-indol-3-yl)propanoic Acid
InChi InChI=1S/C28H26N2O6S/c1-2-3-15-35-22-9-12-24(13-10-22)37(33,34)30-27(28(31)32)16-21-18-29-26-14-11-23(17-25(21)26)36-19-20-7-5-4-6-8-20/h4-14,17-18,27,29-30H,15-16,19H2,1H3,(H,31,32)
InChiKey OPSGGAROSGLASJ-UHFFFAOYSA-N
Formula C28H26N2O6S Molecular Weight 518.58
Cross Link CHEMBL463395
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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