| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | ZS9E5563TQ |
| EPA CompTox | DTXSID80176590 |
| InChI Key | DRDJDNORXOOBHR-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C5H6N4O2 |
| Molecular Weight | 154.05 |
| AlogP | 0.47 |
| Hydrogen Bond Acceptor | 6.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 101.46 |
| Heavy Atoms | 11.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 2209-72-5 |
| NORMAN SUSDAT | |
| FDA SRS | ZS9E5563TQ |
| PubChem | 75162 |
| ChemSpider | 67710.0 |