CFam Chemical Families Database
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You are searching for "CFAMM00401531" 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 CFAMM00401531
Family CFFBM10373 Epidermal growth factor receptor and Receptor tyrosine-protein kinase erbB-4 ligand N-[4-(3-chloro-4-fluoroanilino)pyrido[3,4-d]pyrimidin-6-yl]hex-2-ynamide family
Superfamily CFSBM619 Tyrosine-protein kinase Lck and Epidermal growth factor receptor Binder Superfamily
Class CFCCD33 Class 846
External ID CHEMBL524117 External Source CHEMBL
PubChem CID 44564526 Functional Category Bioactive
Molecule Name AGN-PC-078XBS
IUPAC Name N-[4-[(3-chloro-4-fluorophenyl)methyl]pyrido[3,2-d]pyrimidin-6-yl]prop-2-enamide
Synonyms N-[4-[(3-chloro-4-fluorophenyl)methyl]pyrido[3,2-d]pyrimidin-6-yl]prop-2-enamide
InChi InChI=1S/C17H12ClFN4O/c1-2-16(24)22-15-6-5-13-17(23-15)14(21-9-20-13)8-10-3-4-12(19)11(18)7-10/h2-7,9H,1,8H2,(H,22,23,24)
InChiKey YBZDFXKFZUDAAC-UHFFFAOYSA-N
Formula C17H12ClFN4O Molecular Weight 342.75
Cross Link CHEMBL524117
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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