| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | MT4W9M54L4 |
| EPA CompTox | DTXSID00176870 |
| InChI Key | GWQIRICPSOISHC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C15H13N1O4 |
| Molecular Weight | 271.08 |
| AlogP | 2.08 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 55.84 |
| Heavy Atoms | 20.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 22330-42-3 |
| NORMAN SUSDAT | |
| FDA SRS | MT4W9M54L4 |
| PubChem | 89659 |
| ChemSpider | 80922.0 |