MK-886

Ligand id: 2655

Name: MK-886

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 8
Topological polar surface area 67.53
Molecular weight 471.2
XLogP 8.34
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-[3-tert-butylsulfanyl-1-[(4-chlorophenyl)methyl]-5-propan-2-ylindol-2-yl]-2,2-dimethylpropanoic acid
Synonyms
L 663536 | MK886
Database Links
BindingDB Ligand 50006805
CAS Registry No. 118414-82-7 (source: Scifinder)
ChEBI CHEBI:141530
ChEMBL Ligand CHEMBL29097
PubChem CID 3651377
Search Google for chemical match using the InChIKey QAOAOVKBIIKRNL-UHFFFAOYSA-N
Search Google for chemicals with the same backbone QAOAOVKBIIKRNL
Search UniChem for chemical match using the InChIKey QAOAOVKBIIKRNL-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone QAOAOVKBIIKRNL
Wikipedia MK_886
Comments
MK-886 is an orally active inhibitor of 5-lipoxygenase-activating protein (FLAP) that inhibits leukotriene biosynthesis. The compound is also a PPARα antagonist.