CFam Chemical Families Database
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You are searching for "CFAMM00330882" 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 CFAMM00330882
Family CFFBM2152 Angiopoietin-1 receptor and Aurora kinase B ligand SureCN1265856 family
Superfamily CFSCD210 Platelet-derived growth factor receptor Ligand CP-868596 Superfamily
Class CFCCD163 Class 976
External ID CHEMBL1254839 External Source CHEMBL
PubChem CID 52942177 Functional Category Bioactive
Molecule Name AGN-PC-09M4XA
IUPAC Name 1-[2-chloro-4-(5-methylpyrrolo[3,2-d]pyrimidin-4-yl)oxyphenyl]-3-[4-(1-methylpiperidin-4-yl)oxy-3-(trifluoromethyl)phenyl]urea
Synonyms SureCN4279653;CHEBI:804307;1-[2-chloro-4-(5-methylpyrrolo[3,2-d]pyrimidin-4-yl)oxyphenyl]-3-[4-(1-methylpiperidin-4-yl)oxy-3-(trifluoromethyl)phenyl]urea
InChi InChI=1S/C27H26ClF3N6O3/c1-36-10-7-17(8-11-36)39-23-6-3-16(13-19(23)27(29,30)31)34-26(38)35-21-5-4-18(14-20(21)28)40-25-24-22(32-15-33-25)9-12-37(24)2/h3-6,9,12-15,17H,7-8,10-11H2,1-2H3,(H2,34,35,38)
InChiKey NCTRDRAFCRZEPK-UHFFFAOYSA-N
Formula C27H26ClF3N6O3 Molecular Weight 574.98
Cross Link CHEMBL1254839
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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