CFam Chemical Families Database
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You are searching for "CFAMM00099211" in compound.

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CFAM Mol ID CFAMM00099211
Family CFFAD731 Histamine H1 receptor Ligand Triprolidine Family
Superfamily CFSAD143 Histamine H1 receptor ligand Pheniramine Triprolidine, Nicotinic acetylcholine receptor ligand Nicotine Superfamily
Class CFCAD141 Class 141
External ID CHEMBL125357 External Source CHEMBL
PubChem CID 44351397 Functional Category Bioactive
Molecule Name AGN-PC-075JRA
IUPAC Name oxalic acid;1-pyridin-3-ylpiperazine
Synonyms CHEBI:311716;Piperazine, 1-(3-pyridinyl)-, ethanedioate (1:1)
InChi InChI=1S/C9H13N3.C2H2O4/c1-2-9(8-11-3-1)12-6-4-10-5-7-12;3-1(4)2(5)6/h1-3,8,10H,4-7H2;(H,3,4)(H,5,6)
InChiKey XCVFQEXEEVIFIR-UHFFFAOYSA-N
Formula C9H13N3.C2H2O4 Molecular Weight 253.25
Cross Link CHEMBL125357
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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