CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00181917" in compound.

Total 1 results found.

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 CFAMM00181917
Family CFFID128 Muscarinic acetylcholine receptor M1 Ligand AC-260584 Family
Superfamily CFSID100 Galanin receptor type 2 and Galanin receptor type 1 Binder Superfamily
Class CFCID39 Class 1389
External ID CHEMBL151533 External Source CHEMBL
PubChem CID 9946469 Functional Category Bioactive
Molecule Name SureCN6906626
IUPAC Name 7-[[4-(3,4-dimethylphenyl)piperazin-1-yl]methyl]-4H-1,4-benzoxazin-3-one
Synonyms CHEBI:348430
InChi InChI=1S/C21H25N3O2/c1-15-3-5-18(11-16(15)2)24-9-7-23(8-10-24)13-17-4-6-19-20(12-17)26-14-21(25)22-19/h3-6,11-12H,7-10,13-14H2,1-2H3,(H,22,25)
InChiKey VYJSEMNZGPEKAE-UHFFFAOYSA-N
Formula C21H25N3O2 Molecular Weight 351.44
Cross Link CHEMBL151533
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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