CFam Chemical Families Database
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You are searching for "CFAMM00443126" in compound.

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CFAM Mol ID CFAMM00443126
Family CFFBM17527 RAC-alpha serine/threonine-protein kinase and RAC-gamma serine/threonine-protein kinase inhibitor AGN-PC-04RN0E family
Superfamily CFSBM5385 RAC-alpha serine/threonine-protein kinase and RAC-gamma serine/threonine-protein kinase Binder Superfamily
Class CFCBM234 Class 3284
External ID CHEMBL1801867 External Source CHEMBL
PubChem CID 49857327 Functional Category Bioactive
Molecule Name 4-[(2,4-diamino-5-methyl-7H-pyrrolo[2,3-d]pyrimidin-6-yl)sulfanyl]-N-(2-pyridin-3-ylethyl)benzamide
IUPAC Name 4-[(2,4-diamino-5-methyl-7H-pyrrolo[2,3-d]pyrimidin-6-yl)sulfanyl]-N-(2-pyridin-3-ylethyl)benzamide
Synonyms AGN-PC-088SRI;4-[(2,4-diamino-5-methyl-7H-pyrrolo[2,3-d]pyrimidin-6-yl)sulfanyl]-N-(2-pyridin-3-ylethyl)benzamide
InChi InChI=1S/C21H21N7OS/c1-12-16-17(22)26-21(23)28-18(16)27-20(12)30-15-6-4-14(5-7-15)19(29)25-10-8-13-3-2-9-24-11-13/h2-7,9,11H,8,10H2,1H3,(H,25,29)(H5,22,23,26,27,28)
InChiKey YOXUCKSEOXPTRT-UHFFFAOYSA-N
Formula C21H21N7OS Molecular Weight 419.50
Cross Link CHEMBL1801867
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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