compound 28xvii [PMID: 8809154]

Ligand id: 8764

Name: compound 28xvii [PMID: 8809154]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 10
Topological polar surface area 111.1
Molecular weight 470.18
XLogP 7.8
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-[2-ethyl-1-oxamoyl-3-[[2-(phenylmethyl)phenyl]methyl]indolizin-8-yl]oxyacetic acid
Database Links
ChEMBL Ligand CHEMBL331755
PubChem CID 10389981
Search Google for chemical match using the InChIKey LNIJDTKDAASOIT-UHFFFAOYSA-N
Search Google for chemicals with the same backbone LNIJDTKDAASOIT
Search UniChem for chemical match using the InChIKey LNIJDTKDAASOIT-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone LNIJDTKDAASOIT
Comments
compound 28xvii is reported in [1] as an inhibitor of secretory phospholopase A2 (sPLA2).