General
Preferred name
S-(+)-GABOB
Synonyms
GABOB (beta-hydroxy-GABA) ()
(S)-4-Amino-3-hydroxybutanoic acid ()
P&D ID
PD118693
CAS
7013-05-0
Tags
available
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION S-(+)-GABOB is an endogenous ligand with antiepileptic activity. S-(+)-GABOB is a metabolite of GABA and may function as a neurotransmitter. S-(+)-GABOB behaves as a full agonist when bound to the ¦Ñ(1) wild-type receptor. S-(+)-GABOB acts as a competitive antagonist in the ¦Ñ(1) T244S mutant receptor[1].
DESCRIPTION (S)-4-Amino-3-hydroxybutanoic acid is an inhibitor of GABA receptor. (Enamine Bioactive Compounds)
DESCRIPTION GABOB, also known as γ-Amino-β-hydroxybutyric acid, β-hydroxy-γ-aminobutyric acid, β-hydroxy-GABA, is an anticonvulsant. It is also an endogenous active metabolite and analogue of the neurotransmitter γ-aminobutyric acid (GABA), and for this reason, may function as a neurotransmitter itself. . (BOC Sciences Bioactive Compounds)
Compound Sets
4
BOC Sciences Bioactive Compounds
gabob-beta-hydroxy-gaba-cas-7013-05-0-item-97279
Drug Repurposing Hub
Enamine Bioactive Compounds
EBC-04256
MedChem Express Bioactive Compound Library
HY-W050122
External IDs
20
Properties
(calculated by RDKit )
Molecular Weight
119.06
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
3
Rotatable Bonds
3
Ring Count
0
Aromatic Ring Count
0
cLogP
-1.22
TPSA
83.55
Fraction CSP3
0.75
Chiral centers
1.0
Largest ring
0.0
QED
0.43
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Indication
epilepsy
Target
GABA Receptor
Pathway
Membrane Transporter/Ion Channel
Neuronal Signaling
Solubility
Soluble in DMSO, not in water
Source data