CFam Chemical Families Database
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You are searching for "CFAMM00146676" 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 CFAMM00146676
Family CFFCD256 Sodium channel Ligand GSK1014802 Family
Superfamily CFSCD234 Sodium channel Ligand GSK1014802 Superfamily
Class CFCAD247 Class 247
External ID CHEMBL179574 External Source CHEMBL
PubChem CID 5353745 Functional Category Bioactive
Molecule Name MDL 105,519
IUPAC Name 3-[(Z)-2-carboxy-2-phenylethenyl]-4,6-dichloro-1H-indole-2-carboxylic acid
Synonyms SureCN499903;AC1NS4J8;MLS002153309;(E)-4,6-Dichloro-3-(2-phenyl-2-carboxyethenyl)indole-2-carboxylic acid;CHEBI:398693;HMS2230O18;161230-88-2;DNC012841;SMR001230725
InChi InChI=1S/C18H11Cl2NO4/c19-10-6-13(20)15-12(16(18(24)25)21-14(15)7-10)8-11(17(22)23)9-4-2-1-3-5-9/h1-8,21H,(H,22,23)(H,24,25)/b11-8-
InChiKey LPWVUDLZUVBQGP-FLIBITNWSA-N
Formula C18H11Cl2NO4 Molecular Weight 376.19
Cross Link CHEMBL179574
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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