| Synonyms: | |
| Status: | Approved |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| ATC: | A06AB04 |
| UNII: | 6QK969R2IF |
Structure
| InChI Key | KJFMBFZCATUALV-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C20H14O4 |
| Molecular Weight | 318.33 |
| AlogP | 3.56 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 66.76 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 3.0 |
| Heavy Atoms | 24.0 |
Pharmacology
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Enzyme
Transferase
|
- | - | - | 4700-7000 | - | |
|
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC21/SLCO family of organic anion transporting polypeptides
|
- | - | - | - | 21 |
Indications
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 34914 |
| ChEMBL | CHEMBL63857 |
| DrugBank | DB04824 |
| DrugCentral | 2135 |
| EPA CompTox | DTXSID0021125 |
| FDA SRS | 6QK969R2IF |
| KEGG | C14286 |
| PDB | FGT |
| PubChem | 4764 |
| SureChEMBL | SCHEMBL27670 |
| ZINC | ZINC000003831317 |
CONTENTS