CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00435700" 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 CFAMM00435700
Family CFFBM15716 D(2) dopamine receptor and D(1A) dopamine receptor ligand AGN-PC-00Q2AM family
Superfamily CFSID1009 3-oxo-5-alpha-steroid 4-dehydrogenase 1 Inhibitor 5-(4-chloro-phenyl)-1-methyl-piperidine-2-thione Superfamily
Class CFCAD48 Class 48
External ID CHEMBL420302 External Source CHEMBL
PubChem CID 18790204 Functional Category Bioactive
Molecule Name AGN-PC-022JBU
IUPAC Name 4-(4-chlorophenyl)-1-(4-phenylbutyl)-3,6-dihydro-2H-pyridine
Synonyms SureCN9377531;CHEBI:286202;Pyridine, 4-(4-chlorophenyl)-1,2,3,6-tetrahydro-1-(4-phenylbutyl)-
InChi InChI=1S/C21H24ClN/c22-21-11-9-19(10-12-21)20-13-16-23(17-14-20)15-5-4-8-18-6-2-1-3-7-18/h1-3,6-7,9-13H,4-5,8,14-17H2
InChiKey PWBCBOHXIIXQMW-UHFFFAOYSA-N
Formula C21H24ClN Molecular Weight 325.87
Cross Link CHEMBL420302
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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