KML29

Ligand id: 9482

Name: KML29

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 8
Topological polar surface area 86.69
Molecular weight 549.12
XLogP 5.6
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
1,1,1,3,3,3-hexafluoropropan-2-yl 4-[bis(1,3-benzodioxol-5-yl)-hydroxymethyl]piperidine-1-carboxylate
Database Links
PubChem CID 71656212
Search Google for chemical match using the InChIKey SXHQLPHDBLTFPM-UHFFFAOYSA-N
Search Google for chemicals with the same backbone SXHQLPHDBLTFPM
Search UniChem for chemical match using the InChIKey SXHQLPHDBLTFPM-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone SXHQLPHDBLTFPM
Comments
Highly selective and potent monoacylglycerol lipase (MAGL) inhibitor.