| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID3067235 |
| InChI Key | XLWDHQUMQZTMRU-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C14H18Cl1N1O4 |
| Molecular Weight | 299.09 |
| AlogP | 2.27 |
| Hydrogen Bond Acceptor | 5.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 55.84 |
| Heavy Atoms | 20.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 26692-46-6 |
| NORMAN SUSDAT | |
| PubChem | 117842 |
| ChemSpider | 105304.0 |