| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID70459026 |
| InChI Key | YMBLTOGTYNFTRX-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H10N2O3 |
| Molecular Weight | 182.07 |
| AlogP | 1.15 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 70.08 |
| Heavy Atoms | 13.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 86604-79-7 |
| NORMAN SUSDAT | |
| PubChem | 11217611 |
| ChemSpider | 9392665.0 |