CFam Chemical Families Database
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You are searching for "CFAMM00053401" 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 CFAMM00053401
Family CFFAD368 Sodium channel protein type 5 subunit alpha Ligand Hexylcaine Family
Superfamily CFSAD316 Sodium channel protein type 5 subunit alpha Ligand Hexylcaine Superfamily
Class CFCAD296 Class 296
External ID CHEMBL558819 External Source CHEMBL
PubChem CID 45265138 Functional Category Bioactive
Molecule Name AGN-PC-07C29R
IUPAC Name methyl 4-[[4-[(4-fluorophenyl)methoxymethyl]piperidin-1-yl]methyl]benzoate;hydrochloride
Synonyms methyl 4-[[4-[(4-fluorophenyl)methoxymethyl]piperidin-1-yl]methyl]benzoate;hydrochloride
InChi InChI=1S/C22H26FNO3.ClH/c1-26-22(25)20-6-2-17(3-7-20)14-24-12-10-19(11-13-24)16-27-15-18-4-8-21(23)9-5-18;/h2-9,19H,10-16H2,1H3;1H
InChiKey CUSWXDVRJPXMSE-UHFFFAOYSA-N
Formula C22H27ClFNO3 Molecular Weight 407.91
Cross Link CHEMBL558819
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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