| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 8RF8AN4JFL |
| EPA CompTox | DTXSID90863287 |
| InChI Key | VLYUGYAKYZETRF-SSDOTTSWSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H17NOS2 |
| Molecular Weight | 207.08 |
| AlogP | 2.7 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 4.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 44.08 |
| Heavy Atoms | 12.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 3884-47-7 |
| NORMAN SUSDAT | |
| FDA SRS | 8RF8AN4JFL |
| PubChem | 445160 |