CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00029192" 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 CFAMM00029192
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 CHEMBL1082849 External Source CHEMBL
PubChem CID 46890081 Functional Category Bioactive
Molecule Name AGN-PC-07ZG9Q
IUPAC Name N-ethyl-N-[[4-[8-(4-ethylpiperazin-1-yl)octoxy]phenyl]methyl]ethanamine
Synonyms CHEBI:731559;N-ethyl-N-[[4-[8-(4-ethylpiperazin-1-yl)octoxy]phenyl]methyl]ethanamine
InChi InChI=1S/C25H45N3O/c1-4-26(5-2)23-24-13-15-25(16-14-24)29-22-12-10-8-7-9-11-17-28-20-18-27(6-3)19-21-28/h13-16H,4-12,17-23H2,1-3H3
InChiKey SDCCOIUHZNWQIS-UHFFFAOYSA-N
Formula C25H45N3O Molecular Weight 403.64
Cross Link CHEMBL1082849
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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