CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00172801" 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 CFAMM00172801
Family CFFCD833 JAK Inhibitor Momelotinib Family
Superfamily CFSAD146 Mast/stem cell growth factor receptor Kit and Abelson tyrosine-protein kinase 2 Inhibitor Imatinib Superfamily
Class CFCAD144 Class 144
External ID CHEMBL2171742 External Source CHEMBL
PubChem CID 54755181 Functional Category Bioactive
Molecule Name [3-bromo-4-[[5-chloro-4-(methylamino)pyrimidin-2-yl]amino]phenyl]-morpholin-4-ylmethanone
IUPAC Name [3-bromo-4-[[5-chloro-4-(methylamino)pyrimidin-2-yl]amino]phenyl]-morpholin-4-ylmethanone
Synonyms AGN-PC-0ABYBT;SureCN7450345;[3-bromo-4-[[5-chloro-4-(methylamino)pyrimidin-2-yl]amino]phenyl]-morpholin-4-ylmethanone
InChi InChI=1S/C16H17BrClN5O2/c1-19-14-12(18)9-20-16(22-14)21-13-3-2-10(8-11(13)17)15(24)23-4-6-25-7-5-23/h2-3,8-9H,4-7H2,1H3,(H2,19,20,21,22)
InChiKey NEUJQPMKQRSGQT-UHFFFAOYSA-N
Formula C16H17BrClN5O2 Molecular Weight 426.70
Cross Link CHEMBL2171742
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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