| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | WPS2KSX2TJ |
| EPA CompTox | DTXSID40174850 |
| InChI Key | HCWQGDLBIKOJPM-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C12H19N1O2S1 |
| Molecular Weight | 241.11 |
| AlogP | 2.32 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 44.48 |
| Heavy Atoms | 16.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 207740-24-7 |
| NORMAN SUSDAT | |
| FDA SRS | WPS2KSX2TJ |
| PubChem | 12074193 |
| ChemSpider | 16787961.0 |