| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | IL00Z9WFM8 |
| EPA CompTox | DTXSID40160233 |
| InChI Key | PPAULTVPKLVLII-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C4H6N4 |
| Molecular Weight | 110.06 |
| AlogP | -0.53 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 3.0 |
| Polar Surface Area | 78.55 |
| Heavy Atoms | 8.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 13754-19-3 |
| NORMAN SUSDAT | |
| FDA SRS | IL00Z9WFM8 |
| PubChem | 83703 |
| ChemSpider | 75525.0 |