L-372662

Ligand id: 2253

Name: L-372662

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 8
Topological polar surface area 98.49
Molecular weight 586.28
XLogP 4.47
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
1-[1-[2-methoxy-4-[1-[(2-methyl-1-oxidopyridin-1-ium-3-yl)methyl]piperidin-4-yl]oxybenzoyl]piperidin-4-yl]-4H-3,1-benzoxazin-2-one
Synonyms
L012255 | L372662
Database Links
BindingDB Ligand 50064711
ChEMBL Ligand CHEMBL306645
PubChem CID 5311202
Search Google for chemical match using the InChIKey SKWSXDUHUVMPBT-UHFFFAOYSA-N
Search Google for chemicals with the same backbone SKWSXDUHUVMPBT
Search UniChem for chemical match using the InChIKey SKWSXDUHUVMPBT-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone SKWSXDUHUVMPBT