CFam Chemical Families Database
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You are searching for "CFAMM00331178" 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 CFAMM00331178
Family CFFBM2190 Vascular endothelial growth factor receptor 2 and Fibroblast growth factor receptor 1 ligand AGN-PC-09M5ZH family
Superfamily CFSBM1222 Glucokinase and P2X purinoceptor 7 Binder Superfamily
Class CFCCD480 Class 1293
External ID CHEMBL1254437 External Source CHEMBL
PubChem CID 52949957 Functional Category Bioactive
Molecule Name AGN-PC-09M9US
IUPAC Name 1-(5-tert-butyl-2-methylpyrazol-3-yl)-3-[2-chloro-4-(5-methylpyrrolo[3,2-d]pyrimidin-4-yl)oxyphenyl]urea
Synonyms SureCN4283748;CHEBI:803901;1-(5-tert-butyl-2-methylpyrazol-3-yl)-3-[2-chloro-4-(5-methylpyrrolo[3,2-d]pyrimidin-4-yl)oxyphenyl]urea
InChi InChI=1S/C22H24ClN7O2/c1-22(2,3)17-11-18(30(5)28-17)27-21(31)26-15-7-6-13(10-14(15)23)32-20-19-16(24-12-25-20)8-9-29(19)4/h6-12H,1-5H3,(H2,26,27,31)
InChiKey PTVGLJNCRIJPAG-UHFFFAOYSA-N
Formula C22H24ClN7O2 Molecular Weight 453.92
Cross Link CHEMBL1254437
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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