CFam Chemical Families Database
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You are searching for "CFAMM00179771" 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 CFAMM00179771
Family CFFID78 Squalene synthase Inhibitor (z)-3-[2-(9h-fluoren-2-yloxy)ethylidene]-quinuclidine Hydrochloride 31 Family
Superfamily CFSAD144 Histamine H1 receptor Ligand Doxepin Superfamily
Class CFCAD142 Class 142
External ID CHEMBL397300 External Source CHEMBL
PubChem CID 11668849 Functional Category Bioactive
Molecule Name AGN-PC-00DS0V
IUPAC Name 4-(3-chlorophenyl)-7-[3-(4-fluoropiperidin-1-yl)propoxy]-2-methyl-3,4-dihydro-1H-isoquinoline
Synonyms SureCN1034481;CHEBI:510289;4-(3-chlorophenyl)-7-[3-(4-fluoropiperidin-1-yl)propoxy]-2-methyl-3,4-dihydro-1H-isoquinoline
InChi InChI=1S/C24H30ClFN2O/c1-27-16-19-15-22(29-13-3-10-28-11-8-21(26)9-12-28)6-7-23(19)24(17-27)18-4-2-5-20(25)14-18/h2,4-7,14-15,21,24H,3,8-13,16-17H2,1H3
InChiKey UHXAVJMDFYIMLP-UHFFFAOYSA-N
Formula C24H30ClFN2O Molecular Weight 416.96
Cross Link CHEMBL397300
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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