CFam Chemical Families Database
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You are searching for "CFAMM00489221" 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 CFAMM00489221
Family CFFBM29486 Vascular endothelial growth factor receptor 2 and Serine/threonine-protein kinase PLK1 ligand AGN-PC-07CK5S family
Superfamily CFSBM6199 Aurora kinase A and Ephrin type-A receptor 3 Binder Superfamily
Class CFCCD37 Class 850
External ID CHEMBL598418 External Source CHEMBL
PubChem CID 45379610 Functional Category Bioactive
Molecule Name AGN-PC-07CK5S
IUPAC Name 2-(4-hydroxyanilino)-9-methoxy-5,7-dihydropyrimido[5,4-d][1]benzazepin-6-one
Synonyms CHEBI:696659;2-(4-hydroxyanilino)-9-methoxy-5,7-dihydropyrimido[5,4-d][1]benzazepin-6-one
InChi InChI=1S/C19H16N4O3/c1-26-14-6-7-15-16(9-14)22-17(25)8-11-10-20-19(23-18(11)15)21-12-2-4-13(24)5-3-12/h2-7,9-10,24H,8H2,1H3,(H,22,25)(H,20,21,23)
InChiKey IRDQZYNDOWVJIZ-UHFFFAOYSA-N
Formula C19H16N4O3 Molecular Weight 348.36
Cross Link CHEMBL598418
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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