| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | M9YEG822FE |
| EPA CompTox | DTXSID5063863 |
| InChI Key | RMWYWQJCJOEMTR-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H7N3O6 |
| Molecular Weight | 241.03 |
| AlogP | 1.82 |
| Hydrogen Bond Acceptor | 6.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 139.1 |
| Heavy Atoms | 17.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 5422-72-0 |
| NORMAN SUSDAT | |
| FDA SRS | M9YEG822FE |
| PubChem | 4192962 |
| ChemSpider | 3403516.0 |