| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | H347TX7J9K |
| EPA CompTox | DTXSID4059209 |
| InChI Key | QJAIOCKFIORVFU-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 | 100-23-2 |
| NORMAN SUSDAT | |
| FDA SRS | H347TX7J9K |
| PubChem | 7491 |
| ChemSpider | 7210.0 |