| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | TAG5GUF99V |
| EPA CompTox | DTXSID0070784 |
| InChI Key | GAZROXINNVTWDF-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C18H21N3O6 |
| Molecular Weight | 375.14 |
| AlogP | 0.69 |
| Hydrogen Bond Acceptor | 9.0 |
| Number of Rotational Bond | 12.0 |
| Polar Surface Area | 117.57 |
| Heavy Atoms | 27.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 67893-00-9 |
| NORMAN SUSDAT | |
| FDA SRS | TAG5GUF99V |
| PubChem | 105995 |
| ChemSpider | 72780.0 |