CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00394414" in compound.

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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 CFAMM00394414
Family CFFBM9312 5-hydroxytryptamine receptor 3A and 5-hydroxytryptamine receptor 3B ligand AGN-PC-004F2I family
Superfamily CFSBM4796 B1 bradykinin receptor and Protease Binder Superfamily
Class CFCCD440 Class 1253
External ID CHEMBL559936 External Source CHEMBL
PubChem CID 25000364 Functional Category Bioactive
Molecule Name AGN-PC-04VIUL
IUPAC Name 2-[2-[2-(dimethylamino)ethyl-methylamino]pyridin-3-yl]-5-methyl-3,1-benzoxazin-4-one
Synonyms SureCN8210595;CHEBI:657127;2-[2-[2-(dimethylamino)ethyl-methylamino]pyridin-3-yl]-5-methyl-3,1-benzoxazin-4-one
InChi InChI=1S/C19H22N4O2/c1-13-7-5-9-15-16(13)19(24)25-18(21-15)14-8-6-10-20-17(14)23(4)12-11-22(2)3/h5-10H,11-12H2,1-4H3
InChiKey BAQGGLDDJABHRL-UHFFFAOYSA-N
Formula C19H22N4O2 Molecular Weight 338.40
Cross Link CHEMBL559936
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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