CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00099759" 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 CFAMM00099759
Family CFFAD733 Histamine H1 receptor ligand diphenylpiperidine analog Diphenylpyraline Family
Superfamily CFSAD302 Biogenic amine receptor Diphenhydramine Phendimetrazine Diphenylpyraline Superfamily
Class CFCAD231 Class 231
External ID CHEMBL35239 External Source CHEMBL
PubChem CID 9866284 Functional Category Bioactive
Molecule Name SureCN2991054
IUPAC Name 4-[[4-(2-benzhydryloxyethyl)piperidin-1-yl]methyl]benzonitrile
Synonyms CHEBI:150265
InChi InChI=1S/C28H30N2O/c29-21-24-11-13-25(14-12-24)22-30-18-15-23(16-19-30)17-20-31-28(26-7-3-1-4-8-26)27-9-5-2-6-10-27/h1-14,23,28H,15-20,22H2
InChiKey KSNRMBXMKXZRBH-UHFFFAOYSA-N
Formula C28H30N2O Molecular Weight 410.55
Cross Link CHEMBL35239
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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