| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | G359FGQ2RB |
| EPA CompTox | DTXSID201043756 |
| InChI Key | GQKXCBCSVYJUMI-YCLPISNKNA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C22H23N1O6 |
| Molecular Weight | 397.15 |
| AlogP | 4.66 |
| Hydrogen Bond Acceptor | 6.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 91.81 |
| Heavy Atoms | 29.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 2825-00-5 |
| NORMAN SUSDAT | |
| FDA SRS | G359FGQ2RB |
| PubChem | 5917954 |
| ChemSpider | 4747371.0 |