| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | QIO667518T |
| EPA CompTox | DTXSID901043288 |
| InChI Key | HIPIFFZGPOCRPX-ZZXKWVIFSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C16H15N1O3 |
| Molecular Weight | 269.11 |
| AlogP | 2.99 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 48.42 |
| Heavy Atoms | 20.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 37398-31-5 |
| NORMAN SUSDAT | |
| FDA SRS | QIO667518T |