| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 84DCC7NFH3 |
| EPA CompTox | DTXSID40223413 |
| InChI Key | SONVVDBBKOJLQF-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H8N4O1 |
| Molecular Weight | 164.07 |
| AlogP | -0.48 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 91.33 |
| Heavy Atoms | 12.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 7316-92-9 |
| NORMAN SUSDAT | |
| FDA SRS | 84DCC7NFH3 |
| PubChem | 5385057 |
| ChemSpider | 4532276.0 |