CFam Chemical Families Database
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You are searching for "CFAMM00442597" in compound.

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CFAM Mol ID CFAMM00442597
Family CFFBM17444 Insulin-like growth factor 1 receptor and Mitogen-activated protein kinase 8 ligand AGN-PC-050GPK family
Superfamily CFSBM908 Insulin-like growth factor 1 receptor and Tyrosine-protein kinase JAK2 Binder Superfamily
Class CFCCD161 Class 974
External ID CHEMBL511765 External Source CHEMBL
PubChem CID 25211574 Functional Category Bioactive
Molecule Name GSK2213727A
IUPAC Name 2-[[2-[5-[[2-(dimethylamino)acetyl]amino]-2-methoxy-4-methylanilino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]-6-fluorobenzamide
Synonyms AGN-PC-050BXY;SureCN2206654;SureCN12430223;HMS3304G01;HMS3305G05;pyrrolo[2,3-d]pyrimidine deriv., 11;NCGC00242241-01;AB01092324-01;2-[[2-[5-[[2-(dimethylamino)acetyl]amino]-2-methoxy-4-methylanilino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]-6-fluorobenzamide
InChi InChI=1S/C25H27FN8O3/c1-13-10-19(37-4)18(11-17(13)29-20(35)12-34(2)3)31-25-32-23-14(8-9-28-23)24(33-25)30-16-7-5-6-15(26)21(16)22(27)36/h5-11H,12H2,1-4H3,(H2,27,36)(H,29,35)(H3,28,30,31,32,33)
InChiKey IKWHWJFNGWUVIJ-UHFFFAOYSA-N
Formula C25H27FN8O3 Molecular Weight 506.53
Cross Link CHEMBL511765
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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