CFam Chemical Families Database
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You are searching for "CFAMM00126854" in compound.

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CFAM Mol ID CFAMM00126854
Family CFFCD6 Aurora kinase B and Aurora kinase C Inhibitor SNS-314 Family
Superfamily CFSCD6 Aurora kinase B and Aurora kinase C Inhibitor SNS-314 Superfamily
Class CFCCD4 Class 817
External ID CHEMBL518666 External Source CHEMBL
PubChem CID 25138102 Functional Category Bioactive
Molecule Name AGN-PC-04X1WQ
IUPAC Name 1-[1-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]triazol-4-yl]-3-[3-(trifluoromethyl)phenyl]urea
Synonyms thieno[3,2-d]pyrimidine analogue, 9;1-[1-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]triazol-4-yl]-3-[3-(trifluoromethyl)phenyl]urea
InChi InChI=1S/C18H15F3N8OS/c19-18(20,21)11-2-1-3-12(8-11)25-17(30)26-14-9-29(28-27-14)6-5-22-16-15-13(4-7-31-15)23-10-24-16/h1-4,7-10H,5-6H2,(H,22,23,24)(H2,25,26,30)
InChiKey WYJOWCMPAGGKEI-UHFFFAOYSA-N
Formula C18H15F3N8OS Molecular Weight 448.42
Cross Link CHEMBL518666
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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