| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID60182851 |
| InChI Key | ULNBACHCVNVEHG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H9N3O1 |
| Molecular Weight | 175.07 |
| AlogP | 0.95 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 68.96 |
| Heavy Atoms | 13.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 28692-27-5 |
| NORMAN SUSDAT | |
| PubChem | 120010 |
| ChemSpider | 107138.0 |