| Trade Names: | |
| Synonyms: | |
| Status: | Approved (1957) |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | E0KNA372SZ |
| InChI Key | BFSMWENDZZIWPW-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C23H33IN2O |
| Molecular Weight | 480.43 |
| AlogP | 4.11 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 8.0 |
| Polar Surface Area | 43.09 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 26.0 |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC21/SLCO family of organic anion transporting polypeptides
|
- | - | - | - | 83 |
| Resources | Reference |
|---|---|
| ChEBI | 6044 |
| ChEMBL | CHEMBL1200347 |
| EPA CompTox | DTXSID30221221 |
| FDA SRS | E0KNA372SZ |
| PubChem | 6284 |
| SureChEMBL | SCHEMBL100255 |