| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | RE81DV5UPA |
| EPA CompTox | DTXSID6066812 |
| InChI Key | RIYSFSQPHCAGLS-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H4N4O4 |
| Molecular Weight | 208.02 |
| AlogP | 0.96 |
| Hydrogen Bond Acceptor | 6.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 136.09 |
| Heavy Atoms | 15.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 22603-53-8 |
| NORMAN SUSDAT | |
| FDA SRS | RE81DV5UPA |
| PubChem | 89765 |
| ChemSpider | 81023.0 |