CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00307696" 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 CFAMM00307696
Family CFFBM126 Adenosine receptor A1 and Adenosine receptor A2a ligand NSC658867 family
Superfamily CFSCD265 Serine/threonine-protein kinase mTOR Inhibitor AZD8055 Superfamily
Class CFCCD163 Class 976
External ID CHEMBL185153 External Source CHEMBL
PubChem CID 44393037 Functional Category Bioactive
Molecule Name (6E)-2-amino-4-(1-methylpiperidin-3-yl)-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyridine-3-carbonitrile
IUPAC Name (6E)-2-amino-4-(1-methylpiperidin-3-yl)-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyridine-3-carbonitrile
Synonyms CHEBI:406710
InChi InChI=1S/C18H20N4O/c1-22-8-4-5-12(11-22)14-9-16(21-18(20)15(14)10-19)13-6-2-3-7-17(13)23/h2-3,6-7,9,12,23H,4-5,8,11H2,1H3,(H2,20,21)
InChiKey WQKHIXZHZZBCAG-UHFFFAOYSA-N
Formula C18H20N4O Molecular Weight 308.38
Cross Link CHEMBL185153
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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