CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00052431" 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 CFAMM00052431
Family CFFAD354 Histamine H1 receptor Ligand Diphenhydramine Family
Superfamily CFSAD302 Biogenic amine receptor Diphenhydramine Phendimetrazine Diphenylpyraline Superfamily
Class CFCAD231 Class 231
External ID CHEMBL255055 External Source CHEMBL
PubChem CID 19844661 Functional Category Bioactive
Molecule Name Piperazine, 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-(2-propenyl)-
IUPAC Name 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-prop-2-enylpiperazine
Synonyms 112931-81-4;ACMC-20mh8s;AGN-PC-02KW1T;SureCN10575011;CTK0D0715;CHEBI:519363
InChi InChI=1S/C22H26F2N2O/c1-2-11-25-12-14-26(15-13-25)16-17-27-22(18-3-7-20(23)8-4-18)19-5-9-21(24)10-6-19/h2-10,22H,1,11-17H2
InChiKey JXVNXJMNUWSGLA-UHFFFAOYSA-N
Formula C22H26F2N2O Molecular Weight 372.45
Cross Link CHEMBL255055
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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