CFam Chemical Families Database
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You are searching for "CFAMM00230140" 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 CFAMM00230140
Family CFFID1166 Acetylcholinesterase Inhibitor Velnacrine Family
Superfamily CFSID942 Metabotropic glutamate receptor 5 and Acetylcholinesterase Binder Superfamily
Class CFCAD183 Class 183
External ID CHEMBL217253 External Source CHEMBL
PubChem CID 16090631 Functional Category Bioactive
Molecule Name AGN-PC-00SUHJ
IUPAC Name 1-[4-[4-(3,4-dimethylpiperazin-1-yl)anilino]-2-methylquinolin-3-yl]ethanol
Synonyms CHEBI:460751;1-[4-[4-(3,4-dimethylpiperazin-1-yl)anilino]-2-methylquinolin-3-yl]ethanol
InChi InChI=1S/C24H30N4O/c1-16-15-28(14-13-27(16)4)20-11-9-19(10-12-20)26-24-21-7-5-6-8-22(21)25-17(2)23(24)18(3)29/h5-12,16,18,29H,13-15H2,1-4H3,(H,25,26)
InChiKey VIFJNFUXJIBEDW-UHFFFAOYSA-N
Formula C24H30N4O Molecular Weight 390.52
Cross Link CHEMBL217253
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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