CFam Chemical Families Database
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You are searching for "CFAMM00278034" 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 CFAMM00278034
Family CFFID2861 Glycogen synthase kinase-3 beta Inhibitor CHIR-98023 Family
Superfamily CFSID2026 Glycogen synthase kinase-3 beta Inhibitor CHIR-98023 Superfamily
Class CFCCD33 Class 846
External ID CHEMBL344404 External Source CHEMBL
PubChem CID 10625454 Functional Category Bioactive
Molecule Name 1-[2-[(3,4-dichlorophenyl)methyl-(5-nitropyridin-2-yl)amino]ethyl]-3-[3-(1H-imidazol-5-yl)propyl]thiourea
IUPAC Name 1-[2-[(3,4-dichlorophenyl)methyl-(5-nitropyridin-2-yl)amino]ethyl]-3-[3-(1H-imidazol-5-yl)propyl]thiourea
Synonyms CHEBI:336835;L017250
InChi InChI=1S/C21H23Cl2N7O2S/c22-18-5-3-15(10-19(18)23)13-29(20-6-4-17(12-27-20)30(31)32)9-8-26-21(33)25-7-1-2-16-11-24-14-28-16/h3-6,10-12,14H,1-2,7-9,13H2,(H,24,28)(H2,25,26,33)
InChiKey YKUBAORRJVYOOP-UHFFFAOYSA-N
Formula C21H23Cl2N7O2S Molecular Weight 508.42
Cross Link CHEMBL344404
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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