| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID0070811 |
| InChI Key | BWOZYUXKRAILOH-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C22H17N1O3 |
| Molecular Weight | 343.12 |
| AlogP | 4.52 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 55.4 |
| Heavy Atoms | 26.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 67905-52-6 |
| NORMAN SUSDAT | |
| PubChem | 106049 |
| ChemSpider | 95541.0 |