| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | X2K99TM19Q |
| EPA CompTox | DTXSID0024555 |
| InChI Key | GAUZCKBSTZFWCT-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C12H11N2O1 |
| Molecular Weight | 198.08 |
| AlogP | 3.61 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 38.43 |
| Heavy Atoms | 15.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 495-48-7 |
| NORMAN SUSDAT | |
| FDA SRS | X2K99TM19Q |
| PubChem | 10316 |
| ChemSpider | 9894.0 |