| Synonyms | |
| Status | |
| Molecule Category | Free-form |
| UNII | 9E338QE28F |
| EPA CompTox | DTXSID9023253 |
| InChI Key | XADCESSVHJOZHK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C15H21NO2 |
| Molecular Weight | 247.34 |
| AlogP | 2.21 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 29.54 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 18.0 |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Ion channel
Voltage-gated ion channel
Potassium channels
Voltage-gated potassium channel
|
- | 323.59 | - | - | - | |
|
Membrane receptor
Family A G protein-coupled receptor
Peptide receptor (family A GPCR)
Short peptide receptor (family A GPCR)
Opioid receptor
|
700 | 315-500 | - | 451 | - | |
|
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC06 neurotransmitter transporter family
|
- | - | - | 412 | - |
| Resources | Reference |
|---|---|
| ChEBI | 6754 |
| ChEMBL | CHEMBL607 |
| DrugBank | DB00454 |
| DrugCentral | 1690 |
| FDA SRS | 9E338QE28F |
| Human Metabolome Database | HMDB0014597 |
| Guide to Pharmacology | 7221 |
| KEGG | C07128 |
| PharmGKB | PA450369 |
| PubChem | 4058 |
| SureChEMBL | SCHEMBL25431 |
| ZINC | ZINC000000001681 |