CFam Chemical Families Database
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You are searching for "CFAMM00169593" in compound.

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CFAM Mol ID CFAMM00169593
Family CFFCD720 Multiple kinase Inhibitor MGCD265 Family
Superfamily CFSCD294 Multiple kinase and Aurora kinase A Binder Superfamily
Class CFCCD172 Class 985
External ID CHEMBL449757 External Source CHEMBL
PubChem CID 44564665 Functional Category Bioactive
Molecule Name AGN-PC-078XEQ
IUPAC Name N-[3-fluoro-4-[2-[1-(3-pyrrolidin-1-ylpropyl)imidazol-4-yl]thieno[3,2-b]pyridin-7-yl]oxyphenyl]-2-oxo-3-phenylimidazolidine-1-carboxamide
Synonyms SureCN5585709;CHEBI:557281;N-[3-fluoro-4-[2-[1-(3-pyrrolidin-1-ylpropyl)imidazol-4-yl]thieno[3,2-b]pyridin-7-yl]oxyphenyl]-2-oxo-3-phenylimidazolidine-1-carboxamide
InChi InChI=1S/C33H32FN7O3S/c34-25-19-23(37-32(42)41-18-17-40(33(41)43)24-7-2-1-3-8-24)9-10-28(25)44-29-11-12-35-26-20-30(45-31(26)29)27-21-39(22-36-27)16-6-15-38-13-4-5-14-38/h1-3,7-12,19-22H,4-6,13-18H2,(H,37,42)
InChiKey HBNFTDDTRWSQBS-UHFFFAOYSA-N
Formula C33H32FN7O3S Molecular Weight 625.72
Cross Link CHEMBL449757
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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