| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID1067621 |
| InChI Key | XEZPSTVEIZNGRR-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C17H18N2O4 |
| Molecular Weight | 314.13 |
| AlogP | 2.02 |
| Hydrogen Bond Acceptor | 6.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 104.64 |
| Heavy Atoms | 23.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 31383-81-0 |
| NORMAN SUSDAT | |
| PubChem | 94419 |
| ChemSpider | 85209.0 |