CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00241918" 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 CFAMM00241918
Family CFFID1538 5-hydroxytryptamine receptor 1A and D(2) dopamine receptor Ligand 4-benzyl-1-chroman-2-ylmethyl-piperidine Family
Superfamily CFSAD297 Alpha adrenergic receptor Ligand Phenoxybenzamine Superfamily
Class CFCAD280 Class 280
External ID 21472216 External Source PubChem
PubChem CID 21472216 Functional Category Patent Compound
Molecule Name AGN-PC-03BDFU
IUPAC Name 1-benzyl-4-[2-(4-bromophenoxy)butyl]piperazine
Synonyms SureCN8029654;1-benzyl-4-[2-(4-bromophenoxy)butyl]piperazine
InChi InChI=1S/C21H27BrN2O/c1-2-20(25-21-10-8-19(22)9-11-21)17-24-14-12-23(13-15-24)16-18-6-4-3-5-7-18/h3-11,20H,2,12-17H2,1H3
InChiKey FLCPJVBHEDJAES-UHFFFAOYSA-N
Formula C21H27BrN2O Molecular Weight 403.36
Cross Link
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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