General
Preferred name
N-ACETYLASPARTIC ACID
Synonyms
Aspartic acid, N-acetyl (R,S) ()
N-Acetyl-L-aspartic acid ()
(S)-2-Acetamidosuccinate ()
N-Acetylaspartate ()
P&D ID
PD001229
CAS
997-55-7
2545-40-6
Tags
available
natural product
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
2
MedChem Express Bioactive Compound Library
Selleckchem Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
43
Properties
(calculated by RDKit )
Molecular Weight
175.05
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
3
Rotatable Bonds
4
Ring Count
0
Aromatic Ring Count
0
cLogP
-0.95
TPSA
103.7
Fraction CSP3
0.5
Chiral centers
1.0
Largest ring
0.0
QED
0.51
QED
0.51
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Metabolic Enzyme/Protease
Target
Endogenous Metabolite
Source data
