| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID80888904 |
| InChI Key | SXIKWSUXCBSFTQ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C19H20Cl1N5O3S1 |
| Molecular Weight | 433.1 |
| AlogP | 5.58 |
| Hydrogen Bond Acceptor | 8.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 9.0 |
| Polar Surface Area | 110.64 |
| Heavy Atoms | 29.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 122371-93-1 |
| NORMAN SUSDAT | |
| PubChem | 12116632 |
| ChemSpider | 57430835.0 |