| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID8068882 |
| InChI Key | LKDJOSCYSCYSJE-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C14H17N1O2 |
| Molecular Weight | 231.13 |
| AlogP | 2.26 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 41.49 |
| Heavy Atoms | 17.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 53815-85-3 |
| NORMAN SUSDAT | |
| PubChem | 104613 |
| ChemSpider | 94446.0 |