β-D-hydroxybutyric acid

Ligand id: 1593

Name: β-D-hydroxybutyric acid

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 2
Topological polar surface area 57.53
Molecular weight 104.05
XLogP -0.5
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

View interactive charts of activity data from ChEMBL and GtoPdb across species (New!)

Natural/Endogenous Targets
Target
HCA2 receptor
Transporters Moving this Compound Across a Lipid Membrane
Transporter EC number Reaction Reference
Monocarboxylate transporter 1
SMCT1
Selectivity at human GPCRs
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
HCA2 receptor Agonist Full agonist 3.1 pEC50 - 1
pEC50 3.1 [1]
Selectivity at mouse GPCRs
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
HCA2 receptor Agonist Full agonist 3.5 pEC50 - 1
pEC50 3.5 [1]
Additional information and targets (data relate to human unless otherwise stated)
Description Data Reference