| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | GZ78W0R94U |
| EPA CompTox | DTXSID30184943 |
| InChI Key | SJODITPGMMSNRF-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 | 3096-57-9 |
| NORMAN SUSDAT | |
| FDA SRS | GZ78W0R94U |
| PubChem | 18357 |
| ChemSpider | 17336.0 |