| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID50198123 |
| InChI Key | HJFUELYSJZDVSR-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C16H15N1O4 |
| Molecular Weight | 285.1 |
| AlogP | 2.47 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 55.84 |
| Heavy Atoms | 21.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 49850-04-6 |
| NORMAN SUSDAT | |
| PubChem | 6452174 |
| ChemSpider | 4954615.0 |