CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00314083" 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 CFAMM00314083
Family CFFBM657 Histamine H3 receptor and Potassium voltage-gated channel subfamily H member 2 ligand SureCN1641496 family
Superfamily CFSBM343 Acetylcholinesterase and Histamine H3 receptor Binder Superfamily
Class CFCBM134 Class 3184
External ID CHEMBL76109 External Source CHEMBL
PubChem CID 13200219 Functional Category Bioactive
Molecule Name AGN-PC-00LF4F
IUPAC Name N,N-dimethyl-2-(3-propylquinolin-2-yl)sulfanylethanamine;oxalic acid
Synonyms N,N-dimethyl-2-(3-propylquinolin-2-yl)sulfanylethanamine;oxalic acid
InChi InChI=1S/C16H22N2S.C2H2O4/c1-4-7-14-12-13-8-5-6-9-15(13)17-16(14)19-11-10-18(2)3;3-1(4)2(5)6/h5-6,8-9,12H,4,7,10-11H2,1-3H3;(H,3,4)(H,5,6)
InChiKey WEFMQLYCZNGOAL-UHFFFAOYSA-N
Formula C16H22N2S.C2H2O4 Molecular Weight 364.46
Cross Link CHEMBL76109
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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