CFam Chemical Families Database
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You are searching for "CFAMM00414197" in compound.

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CFAM Mol ID CFAMM00414197
Family CFFBM12166 Ribosomal protein S6 kinase alpha-3 inhibitor (E)-3-[4-amino-7-(3-hydroxypropyl)-5-(4-methylphenyl)pyrrolo[2,3-d]pyrimidin-6-yl]-N-tert-butyl-2-cyanoprop-2-enamide family
Superfamily CFSBM4895 Ribosomal protein S6 kinase alpha-3 and Mitogen-activated protein kinase 13 Binder Superfamily
Class CFCAD144 Class 144
External ID CHEMBL515414 External Source CHEMBL
PubChem CID 644243 Functional Category Bioactive
Molecule Name 821794-92-7
IUPAC Name 1-[4-amino-7-(3-hydroxypropyl)-5-(4-methylphenyl)pyrrolo[2,3-d]pyrimidin-6-yl]-2-fluoroethanone
Synonyms FMK;AC1LD8U9;CHEBI:558490;HY-52101A;CS-0648;QC-8903;KB-77351;fluoromethylketone-pyrrolopyrimidine scaffold;FMK|821794-92-7
InChi InChI=1S/C18H19FN4O2/c1-11-3-5-12(6-4-11)14-15-17(20)21-10-22-18(15)23(7-2-8-24)16(14)13(25)9-19/h3-6,10,24H,2,7-9H2,1H3,(H2,20,21,22)
InChiKey IKLGYJACVCXYIL-UHFFFAOYSA-N
Formula C18H19FN4O2 Molecular Weight 342.37
Cross Link CHEMBL515414
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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