| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | R50Y14M25S |
| EPA CompTox | DTXSID30197437 |
| InChI Key | JYSDXODDWAQWJR-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H13N1O2S1 |
| Molecular Weight | 199.07 |
| AlogP | 2.12 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 52.32 |
| Heavy Atoms | 13.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 4815-24-1 |
| NORMAN SUSDAT | |
| FDA SRS | R50Y14M25S |
| PubChem | 78536 |
| ChemSpider | 70897.0 |