L-798,106

Ligand id: 1941

Name: L-798,106

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 80.85
Molecular weight 535.05
XLogP 10.81
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(E)-N-(5-bromo-2-methoxyphenyl)sulfonyl-3-[2-(naphthalen-2-ylmethyl)phenyl]prop-2-enamide
Synonyms
L-798106 | L798106
Database Links
BindingDB Ligand 50193922
ChEMBL Ligand CHEMBL218071
PubChem CID 15551229
Search Google for chemical match using the InChIKey ODTKFNUPVBULRJ-NTCAYCPXSA-N
Search Google for chemicals with the same backbone ODTKFNUPVBULRJ
Search UniChem for chemical match using the InChIKey ODTKFNUPVBULRJ-NTCAYCPXSA-N
Search UniChem for chemicals with the same backbone ODTKFNUPVBULRJ
Comments
L-798,106 is a potent and highly selective EP3 receptor antagonist. L-826266 and L-798,106 are similar, except L-826266 has a Cl-group and L-798,106 does not.