GABA

Ligand id: 1067

Name: GABA

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 3
Topological polar surface area 63.32
Molecular weight 103.06
XLogP -0.67
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
IUPAC Name
4-Aminobutanoic acid
Synonyms
γ-amino butyric acid | 4-aminobutyric acid | gamma-aminobutyric acid
Database Links
BindingDB Ligand 24183
CAS Registry No. 56-12-2
ChEBI CHEBI:16865
ChEMBL Ligand CHEMBL96
DrugBank Ligand DB02530
GtoPdb PubChem SID 135651489
PubChem CID 119
RCSB PDB Ligand ABU
Search Google for chemical match using the InChIKey BTCSSZJGUNDROE-UHFFFAOYSA-N
Search Google for chemicals with the same backbone BTCSSZJGUNDROE
Search UniChem for chemical match using the InChIKey BTCSSZJGUNDROE-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone BTCSSZJGUNDROE
SynPHARM 2814 (in complex with GABAB receptor)
Wikipedia Gamma-Aminobutyric_acid

Product suppliers

Tocris
GABA
Cat. No. 0344