| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 664B3AVZ42 |
| EPA CompTox | DTXSID60226269 |
| InChI Key | JAXCBQWXGCQMLT-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C30H22N2O6 |
| Molecular Weight | 506.15 |
| AlogP | 4.98 |
| Hydrogen Bond Acceptor | 6.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 110.8 |
| Heavy Atoms | 38.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 75311-81-8 |
| NORMAN SUSDAT | |
| FDA SRS | 664B3AVZ42 |
| PubChem | 20348215 |
| ChemSpider | 15296254.0 |