CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00101936" 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 CFAMM00101936
Family CFFAD766 Enoyl-[acyl-carrier-protein] reductase [NADH] Inhibitor Ethionamide Family
Superfamily CFSAD143 Histamine H1 receptor ligand Pheniramine Triprolidine, Nicotinic acetylcholine receptor ligand Nicotine Superfamily
Class CFCAD141 Class 141
External ID DNC001218 External Source TTD
PubChem CID 5310967 Functional Category Investigative Drug
Molecule Name RJR-2403
IUPAC Name (E)-N-methyl-4-pyridin-3-ylbut-3-en-1-amine
Synonyms Rivanicline;Trans-metanicotine;RJR 2403;3-Buten-1-amine, N-methyl-4-(3-pyridinyl)-;NSC 66331;AI3-18211;RJR-2403;Pyridine, 3-(4-(methylamino)-1-butenyl)-;15585-43-0;538-79-4
InChi InChI=1S/C10H14N2/c1-11-7-3-2-5-10-6-4-8-12-9-10/h2,4-6,8-9,11H,3,7H2,1H3/b5-2+
InChiKey JUOSGGQXEBBCJB-GORDUTHDSA-N
Formula C10H14N2 Molecular Weight 162.23
Cross Link CHEMBL132966 DB05855
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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