| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 9UX7T559VE |
| EPA CompTox | DTXSID90161179 |
| InChI Key | VDKWJWFQFPWXFC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H7N3O6 |
| Molecular Weight | 241.03 |
| AlogP | 1.97 |
| Hydrogen Bond Acceptor | 6.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 129.42 |
| Heavy Atoms | 17.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 13985-60-9 |
| NORMAN SUSDAT | |
| FDA SRS | 9UX7T559VE |
| PubChem | 26373 |
| ChemSpider | 24569.0 |