CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00289545" 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 CFAMM00289545
Family CFFID3362 Muscarinic acetylcholine receptor M1 and Muscarinic acetylcholine receptor M2 Ligand 1'-benzyl-3-phenyl-[3,4']bipiperidinyl-2,6-dione Family
Superfamily CFSID2332 Muscarinic acetylcholine receptor M1 and Muscarinic acetylcholine receptor M2 Binder Superfamily 3
Class CFCCD249 Class 1062
External ID CHEMBL378665 External Source CHEMBL
PubChem CID 11407510 Functional Category Bioactive
Molecule Name AGN-PC-008HWE
IUPAC Name 4-(4-fluorophenyl)-8-[1-(2-methylphenyl)cyclohexyl]-2,8-diazaspiro[4.5]decan-1-one
Synonyms SureCN5556300;CHEBI:455088;4-(4-fluorophenyl)-8-[1-(2-methylphenyl)cyclohexyl]-2,8-diazaspiro[4.5]decan-1-one
InChi InChI=1S/C27H33FN2O/c1-20-7-3-4-8-23(20)27(13-5-2-6-14-27)30-17-15-26(16-18-30)24(19-29-25(26)31)21-9-11-22(28)12-10-21/h3-4,7-12,24H,2,5-6,13-19H2,1H3,(H,29,31)
InChiKey HQSPTAIHUHMQIB-UHFFFAOYSA-N
Formula C27H33FN2O Molecular Weight 420.56
Cross Link CHEMBL378665
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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