| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID3071642 |
| InChI Key | NOXHIROCWZYZHM-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C17H17N3O4 |
| Molecular Weight | 327.12 |
| AlogP | 1.53 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 78.0 |
| Heavy Atoms | 24.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 68541-03-7 |
| NORMAN SUSDAT | |
| PubChem | 110521 |
| ChemSpider | 4942109.0 |