CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00177382" 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.

Search Results

CFAM Mol ID CFAMM00177382
Family CFFID64 Cytochrome P450 2D6 and Delta-type opioid receptor Ligand 4-(spiro[chromene-2,4'-piperidine]-4-yl)benzamide Family
Superfamily CFSID49 Cytochrome P450 2D6 and Delta-type opioid receptor Binder Superfamily
Class CFCAD216 Class 216
External ID CHEMBL61478 External Source CHEMBL
PubChem CID 10526928 Functional Category Bioactive
Molecule Name [3-[[4-hydroxy-4-(2-propan-2-yloxyphenyl)piperidin-1-yl]methyl]phenyl]-piperidin-1-ylmethanone
IUPAC Name [3-[[4-hydroxy-4-(2-propan-2-yloxyphenyl)piperidin-1-yl]methyl]phenyl]-piperidin-1-ylmethanone
Synonyms CHEBI:194442
InChi InChI=1S/C27H36N2O3/c1-21(2)32-25-12-5-4-11-24(25)27(31)13-17-28(18-14-27)20-22-9-8-10-23(19-22)26(30)29-15-6-3-7-16-29/h4-5,8-12,19,21,31H,3,6-7,13-18,20H2,1-2H3
InChiKey TWXBHMQLKGPCTM-UHFFFAOYSA-N
Formula C27H36N2O3 Molecular Weight 436.59
Cross Link CHEMBL61478
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
 

 

27752 visits since 2014 .........

 



Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


All rights reserved.

   
 
 
Computer-aided Drug Design
about BIDD |  databases |  software |  teaching |  research |  links

 

Department of Computational Science | National University of Singapore | Blk S17, 3 Science Drive 2, Singapore 117543

hdnkeywordtype:MiniFieldStorage('hdnkeywordtype', 'compound'),None, hdnkeywordtype, compound|txtsearch:MiniFieldStorage('txtsearch', 'CFAMM00177382'),None, txtsearch, CFAMM00177382|