| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 1O6X3ML5IP |
| EPA CompTox | DTXSID80195387 |
| InChI Key | FFWCEONGEXZNFU-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C13H9N1O1 |
| Molecular Weight | 195.07 |
| AlogP | 2.48 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 43.09 |
| Heavy Atoms | 15.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 4269-15-2 |
| NORMAN SUSDAT | |
| FDA SRS | 1O6X3ML5IP |
| PubChem | 20267 |
| ChemSpider | 19093.0 |