| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID20173068 |
| InChI Key | QPOWUYJWCJRLEE-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C11H8N2O1 |
| Molecular Weight | 184.06 |
| AlogP | 1.71 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 42.85 |
| Heavy Atoms | 14.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 19437-26-4 |
| NORMAN SUSDAT | |
| PubChem | 88065 |
| ChemSpider | 79450.0 |