| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | R8SPF43RE7 |
| EPA CompTox | DTXSID30993613 |
| InChI Key | JBTCEUXHFCUMJC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C10H10N2O3 |
| Molecular Weight | 206.07 |
| AlogP | 1.02 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 96.34 |
| Heavy Atoms | 15.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 72817-97-1 |
| NORMAN SUSDAT | |
| FDA SRS | R8SPF43RE7 |
| PubChem | 3018374 |