General
Preferred name
SPAGLUMIC ACID
Synonyms
Acidum spaglumicum ()
β-Spaglumic acid ()
β-NAAG ()
β-N-Acetylaspartylglutamic acid ()
N-Acetyl-β-Asp-Glu ()
Acido espaglumico ()
NSC-758468 ()
Acide spaglumique ()
N-Acetyl-??-Asp-Glu ()
P&D ID
PD000970
CAS
4910-46-7
Tags
available
drug
Drug Status
approved
investigational
experimental
Max Phase
2.0
Drug indication
Nasal congestion
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
PRICE 29
DESCRIPTION N-Acetyl-??-Asp-Glu is a peptide neurotransmitter, the third most common neurotransmitter in the mammalian nervous system. NAAG consists of N-acetylaspartate (NAA) and glutamate coupled via a peptide bond.
DESCRIPTION N-Acetyl-β-Asp-Glu, the third-most-prevalent peptide neurotransmitter in the mammalian nervous system, is a non-hydrolyzable NAAG isomer that is a selective metabotropic glutamate receptor-3 (mGluR3) antagonist and NAAG peptidase inhibitor. It is a mast cell stabilizer and can be used for allergic conjunctivitis and other allergic diseases. (BOC Sciences Bioactive Compounds)
Compound Sets
7
BOC Sciences Bioactive Compounds
n-acetyl-asp-glu-cas-4910-46-7-item-119336
ChEMBL Drugs
CHEMBL2105616
DrugBank
DB08835
DrugCentral
4050
DrugCentral Approved Drugs
4050
MedChem Express Bioactive Compound Library
HY-130553
NPC Screening Collection
External IDs
22
Properties
(calculated by RDKit )
Molecular Weight
304.09
Hydrogen Bond Acceptors
5
Hydrogen Bond Donors
5
Rotatable Bonds
9
Ring Count
0
Aromatic Ring Count
0
cLogP
-1.6
TPSA
170.1
Fraction CSP3
0.55
Chiral centers
2.0
Largest ring
0.0
QED
0.34
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
Aminopeptidase
mGluR
Pathway
GPCR/G protein
Metabolic Enzyme/Protease
Neuronal Signaling
Solubility
Soluble in DMSO
Source data