| Synonyms | |
| Status | |
| Molecule Category | Free-form |
| ATC | N06AX09 |
| UNII | 5I5Y2789ZF |
| EPA CompTox | DTXSID6057900 |
| InChI Key | YWPHCCPCQOJSGZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C13H19NO3 |
| Molecular Weight | 237.3 |
| AlogP | 1.45 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 39.72 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 17.0 |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC06 neurotransmitter transporter family
|
- | - | 155-155 | 170 | - |
| Resources | Reference |
|---|---|
| ChEBI | 94405 |
| ChEMBL | CHEMBL306700 |
| DrugBank | DB09185 |
| DrugCentral | 2820 |
| FDA SRS | 5I5Y2789ZF |
| PubChem | 5666 |
| SureChEMBL | SCHEMBL34168 |