| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 3V3FDT3X0M |
| EPA CompTox | DTXSID5059119 |
| InChI Key | BCXSVFBDMPSKPT-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H7N3O1 |
| Molecular Weight | 149.06 |
| AlogP | 0.85 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 3.0 |
| Polar Surface Area | 74.93 |
| Heavy Atoms | 11.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 95-23-8 |
| NORMAN SUSDAT | |
| FDA SRS | 3V3FDT3X0M |
| PubChem | 66765 |
| ChemSpider | 60131.0 |