CFam Chemical Families Database
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You are searching for "CFAMM00144220" 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 CFAMM00144220
Family CFFCD222 Receptor tyrosine-protein kinase erbB-2 Inhibitor CP-724714 Family
Superfamily CFSCD200 Receptor tyrosine-protein kinase erbB-2 Inhibitor CP-724714 Superfamily
Class CFCCD37 Class 850
External ID CHEMBL1760053 External Source CHEMBL
PubChem CID 20826947 Functional Category Bioactive
Molecule Name AGN-PC-030FAZ
IUPAC Name 4-N-quinolin-3-yl-2-N-[3-(trifluoromethoxy)phenyl]pyrimidine-2,4-diamine
Synonyms CHEBI:1237322;2,4-Pyrimidinediamine, N4-3-quinolinyl-N2-[3-(trifluoromethoxy)phenyl]-
InChi InChI=1S/C20H14F3N5O/c21-20(22,23)29-16-6-3-5-14(11-16)27-19-24-9-8-18(28-19)26-15-10-13-4-1-2-7-17(13)25-12-15/h1-12H,(H2,24,26,27,28)
InChiKey STHVTKZXFWHACQ-UHFFFAOYSA-N
Formula C20H14F3N5O Molecular Weight 397.35
Cross Link CHEMBL1760053
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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