CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00029133" in compound.

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CFAM Mol ID CFAMM00029133
Family CFFAD163 Serotonin re-uptake Inhibitor Fluoxetine Family
Superfamily CFSAD152 monoamine reuptake and receptor binding Fluoxetine Reboxetine Bevantolol Nebivolol Superfamily
Class CFCAD149 Class 149
External ID CHEMBL1770405 External Source CHEMBL
PubChem CID 18678296 Functional Category Bioactive
Molecule Name AGN-PC-01ZNA4
IUPAC Name methyl 1-[2-(4-benzylphenoxy)ethyl]pyrrolidine-2-carboxylate
Synonyms methyl 1-[2-(4-benzylphenoxy)ethyl]pyrrolidine-2-carboxylate
InChi InChI=1S/C21H25NO3/c1-24-21(23)20-8-5-13-22(20)14-15-25-19-11-9-18(10-12-19)16-17-6-3-2-4-7-17/h2-4,6-7,9-12,20H,5,8,13-16H2,1H3
InChiKey YLBNNYBEKLKTFP-UHFFFAOYSA-N
Formula C21H25NO3 Molecular Weight 339.43
Cross Link CHEMBL1770405
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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