| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| InChI Key | CEDLKUWEKFRXRC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H7F1N4O1S1 |
| Molecular Weight | 214.03 |
| AlogP | 0.95 |
| Hydrogen Bond Acceptor | 6.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 52.31 |
| Heavy Atoms | 14.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 166524-68-1 |
| NORMAN SUSDAT | |
| PubChem | 11806054 |
| ChemSpider | 9980719.0 |