| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 9QFQ32CUQ5 |
| EPA CompTox | DTXSID5060699 |
| InChI Key | CJDICMLSLYHRPT-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H10N2O2 |
| Molecular Weight | 166.07 |
| AlogP | 1.66 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 46.38 |
| Heavy Atoms | 12.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 619-31-8 |
| NORMAN SUSDAT | |
| FDA SRS | 9QFQ32CUQ5 |
| PubChem | 69269 |
| ChemSpider | 9305580.0 |