Molecular Details
DICL_CP_0310646
- (2S)-2-amino-3-(3,5-dioxo-1,2,4-oxadiazolidin-2-yl)propanoic acid
Basic Molecular Information
Basic Information
DICL ID
DICL_CP_0310646
PubChem CID
Molecular Formula
C5H7N3O5 Molecular Weight
189.127 g/mol
Synonyms/Alias
[QUISQUALIC ACID; Quisqualate; 52809-07-1; L-Quisqualic acid; (+)-Quisqualic acid; Quisqualinic acid; (2S)-2-amino-3-(3;5-dioxo-1;2;4-oxadiazolidin-2-yl)propanoic acid; CHEBI:8734; CHEMBL168279; CHEMB...
InChI Key
ASNFTDCKZKHJSW-REOHCLBHSA-N
InChI
InChI=1S/C5H7N3O5/c6-2(3(9)10)1-8-4(11)7-5(12)13-8/h2H,1,6H2,(H,9,10)(H,7,11,12)/t2-/m0/s1
IUPAC Name
(2S)-2-amino-3-(3,5-dioxo-1,2,4-oxadiazolidin-2-yl)propanoic acid
CAS Number
52809-07-1
Structure Information
Chemical Structure Visualization
SMILES Notation
2D Molecular Drawing
Carbon (C)
Hydrogen (H)
Oxygen (O)
Nitrogen (N)
Sulfur (S)
SDF
20 20 0 0 0 0 0 0 0 0999 V2000
-0.4015 0.7257 -0.9059 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4780 -0.1763 -0.2732 C 0 0 1 0 0 0 0 0 0 0 0 0
-1.5211 -0.000...
Experimental Data
Activity Data
Target Ion Channel
Glutamate receptor 1
Uniprot Accession Number
Function
Antagonist
Species
Rattus norvegicus (Rat)
IC50
IC50: 1 nM
EC50
N/A (Not available)
Ki
N/A (Not available)
Kd
N/A (Not available)
Inhibition
N/A (Not available)
Experimental Conditions
pH
Not mention
Holding Potential
Not specified
Temperature
25 °C
Test Method
Binding assay ([3H] MK801)
Test Species
Rattus norvegicus brain synaptosomal membrane
Binding Information
Binding Site
Transmembrane domain
Binding Site Residue
Not specified
Disease Information
Related Disease
Not specified
References
Computed Properties
Heavy Atom Count
13
Rotatable Bonds
3
logP
-2.4585
Complexity
39.1999
TPSA (Ų)
131.32
H-Bond Donors
3
H-Bond Acceptors
6
Ring Count
1