| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 12133JR80S |
| EPA CompTox | DTXSID00893055 |
| InChI Key | NYHBQMYGNKIUIF-UUOKFMHZSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C10H13N5O5 |
| Molecular Weight | 283.09 |
| AlogP | -2.44 |
| Hydrogen Bond Acceptor | 9.0 |
| Hydrogen Bond Donor | 6.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 160.5 |
| Heavy Atoms | 20.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 118-00-3 |
| NORMAN SUSDAT | |
| FDA SRS | 12133JR80S |
| PubChem | 765 |
| ChemSpider | 745.0 |