| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID6066941 |
| InChI Key | OZQQAZPMNWJRDQ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C28H22N2O4 |
| Molecular Weight | 450.16 |
| AlogP | 5.98 |
| Hydrogen Bond Acceptor | 6.0 |
| Hydrogen Bond Donor | 4.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 98.66 |
| Heavy Atoms | 34.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 23941-48-2 |
| NORMAN SUSDAT | |
| PubChem | 90299 |
| ChemSpider | 81334.0 |