| Synonyms: | |
| Status: | Approved (2006) |
| Entry Type: | Small molecule |
| Molecule Category: | Parent |
| ATC: | G01AD01 |
| UNII: | 33X04XA5AT |
| InChI Key | JVTAAEKCZFNVCJ-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C3H6O3 |
| Molecular Weight | 90.08 |
| AlogP | -0.55 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 57.53 |
| Molecular species | ACID |
| Aromatic Rings | 0.0 |
| Heavy Atoms | 6.0 |
| Action | Mechanism of Action | Reference |
|---|---|---|
| None | pH lowering agent |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Membrane receptor
Family A G protein-coupled receptor
Small molecule receptor (family A GPCR)
Carboxylic acid receptor
Hydroxycarboxylic acid receptor
|
630957.34-1000000 | - | - | - | - |
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Pain | 2 | D010146 | ClinicalTrials |
| Tonsillitis | 1 | D014069 | ClinicalTrials |
| Resources | Reference |
|---|---|
| CAS NUMBER | 50-21-5 |
| ChEBI | 28358 |
| ChEMBL | CHEMBL1200559 |
| DrugBank | DB04398 |
| DrugCentral | 1533 |
| EPA CompTox | DTXSID7023192 |
| FDA SRS | 33X04XA5AT |
| Human Metabolome Database | HMDB0144295 |
| KEGG | C01432 |
| PubChem | 19789253 |
| SureChEMBL | SCHEMBL15902696 |