compound 10h [PMID: 20832306]

Ligand id: 8779

Name: compound 10h [PMID: 20832306]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 3
Rotatable bonds 7
Topological polar surface area 144.99
Molecular weight 497.08
XLogP 3.58
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-[4-carbamoyl-1-[5-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]benzoic acid
Database Links
ChEMBL Ligand CHEMBL1258253
PubChem CID 52944985
Search Google for chemical match using the InChIKey WNFAQVLTRONMFD-UHFFFAOYSA-N
Search Google for chemicals with the same backbone WNFAQVLTRONMFD
Search UniChem for chemical match using the InChIKey WNFAQVLTRONMFD-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone WNFAQVLTRONMFD
Comments
Compound 10h is a potent inhibitor of malonyl-CoA decarboxylase [1]. Such compounds are predicted to have anti-obesity and anti-diabetic activities.