CFam Chemical Families Database
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You are searching for "CFAMM00396575" in compound.

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CFAM Mol ID CFAMM00396575
Family CFFBM9570 Serine/threonine-protein kinase mTOR inhibitor 5-(2-amino-3H-benzimidazol-5-yl)-3-(oxan-4-ylmethyl)-1H-imidazo[4,5-b]pyrazin-2-one family
Superfamily CFSCD170 Prostaglandin G/H synthase 2 Inhibitor Rpr 200765a Superfamily
Class CFCCD107 Class 920
External ID CHEMBL1946265 External Source CHEMBL
PubChem CID 57397773 Functional Category Bioactive
Molecule Name 5-[2-(methylamino)-3H-benzimidazol-5-yl]-3-(oxan-4-ylmethyl)-1H-imidazo[4,5-b]pyrazin-2-one
IUPAC Name 5-[2-(methylamino)-3H-benzimidazol-5-yl]-3-(oxan-4-ylmethyl)-1H-imidazo[4,5-b]pyrazin-2-one
Synonyms AGN-PC-0BTLM6;5-[2-(methylamino)-3H-benzimidazol-5-yl]-3-(oxan-4-ylmethyl)-1H-imidazo[4,5-b]pyrazin-2-one
InChi InChI=1S/C19H21N7O2/c1-20-18-23-13-3-2-12(8-14(13)24-18)15-9-21-16-17(22-15)26(19(27)25-16)10-11-4-6-28-7-5-11/h2-3,8-9,11H,4-7,10H2,1H3,(H2,20,23,24)(H,21,25,27)
InChiKey WNCXJXHENRZPRH-UHFFFAOYSA-N
Formula C19H21N7O2 Molecular Weight 379.42
Cross Link CHEMBL1946265
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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