compound 8 [PMID: 17562362}

Ligand id: 8886

Name: compound 8 [PMID: 17562362}

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 9
Hydrogen bond donors 3
Rotatable bonds 4
Topological polar surface area 141.26
Molecular weight 361.01
XLogP 0.4
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-[(6-chloro-7-methyl-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)-methylsulfonylamino]acetic acid
Comments
Compound 8 is the most potent N-methyl-D-aspartate receptor antagonist reported in [1]. The compound is likely to bind to the glycine binding site of the GluN1 component of the receptor.
Database Links
BindingDB Ligand 50215294
ChEMBL Ligand CHEMBL248247
GtoPdb PubChem SID 310264667
PubChem CID 9863759
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