| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID00940311 |
| InChI Key | PTWWAHZQIATUFG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C18H15ClN2O3 |
| Molecular Weight | 342.08 |
| AlogP | 3.04 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 58.97 |
| Heavy Atoms | 24.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 18818-64-9 |
| NORMAN SUSDAT | |
| PubChem | 86793 |