| Trade Names: | |
| Synonyms: | |
| Status: | Approved (1982) |
| Entry Type: | Small molecule |
| Molecule Category: | Parent |
| UNII: | G9FU7F1E87 |
Structure
| InChI Key | LPRLDRXGWKXRMQ-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C19H24ClNO |
| Molecular Weight | 317.86 |
| AlogP | 3.89 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 0.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 12.47 |
| Molecular species | BASE |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 21.0 |
Pharmacology
| 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
|
- | - | - | - | 69 |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 31508 |
| ChEMBL | CHEMBL1564 |
| EPA CompTox | DTXSID7047772 |
| FDA SRS | G9FU7F1E87 |
| Guide to Pharmacology | 7165 |
| KEGG | D07862 |
| PubChem | 66063 |
| SureChEMBL | SCHEMBL212198 |
| ZINC | ZINC00056643 |
CONTENTS