General
Preferred name
ALANINE
Synonyms
L-2-Aminopropionic acid ()
L-alanine ()
L-Alanine ()
L-Alanine-d3 ()
P&D ID
PD008427
CAS
56-41-7
115967-49-2
77160-91-9
25191-17-7
18875-37-1
130380-93-7
81558-16-9
63546-27-0
Tags
natural product
drug
available
Approved by
FDA
Drug indication
Glioma
Dietary shortage
Drug Status
nutraceutical
approved
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
16
Drug Repurposing Hub
DrugBank
DrugCentral
DrugCentral Approved Drugs
DrugMAP
DrugMAP Approved Drugs
MedChem Express Bioactive Compound Library
NPC Screening Collection
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
65
Properties
(calculated by RDKit )
Molecular Weight
89.05
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
2
Rotatable Bonds
1
Ring Count
0
Aromatic Ring Count
0
cLogP
-0.58
TPSA
63.32
Fraction CSP3
0.67
Chiral centers
1.0
Largest ring
0.0
QED
0.45
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
AARS, AARS2, ABAT, AGXT, AGXT2, GPRC6A, GPT, GPT2, KYNU, NFS1, PHYKPL, SLC1A4, SLC36A1, SLC7A8
Endogenous Metabolite
Therapeutic Class
Dietary supplement
Pathway
Metabolic Enzyme/Protease
Source data