| Synonyms: | |
| Status: | Phase 2 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | 1WBO45T413 |
| InChI Key | FBQUXLIJKPWCAO-AZIFJQEOSA-N |
|---|---|
| Smile | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C24H34O6S |
| Molecular Weight | 450.6 |
| AlogP | 2.94 |
| Hydrogen Bond Acceptor | 7.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 13.0 |
| Polar Surface Area | 93.06 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 31.0 |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Membrane receptor
Family A G protein-coupled receptor
Small molecule receptor (family A GPCR)
Lipid-like ligand receptor (family A GPCR)
Prostanoid receptor
|
2 | - | - | 56 | - |
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Colitis, Ulcerative | 2 | D003093 | ClinicalTrials |
| Resources | Reference |
|---|---|
| ChEBI | 168543 |
| ChEMBL | CHEMBL303960 |
| DrugBank | DB16315 |
| FDA SRS | 1WBO45T413 |
| Guide to Pharmacology | 1930 |
| PubChem | 9803828 |
| SureChEMBL | SCHEMBL2309978 |
| ZINC | ZINC000003940680 |