| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | X2MM4WR3KL |
| EPA CompTox | DTXSID70178669 |
| InChI Key | RUKRYLBUAIGWQI-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C12H22O4S2 |
| Molecular Weight | 294.1 |
| AlogP | 3.05 |
| Hydrogen Bond Acceptor | 6.0 |
| Number of Rotational Bond | 11.0 |
| Polar Surface Area | 52.6 |
| Heavy Atoms | 18.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 23959-95-7 |
| NORMAN SUSDAT | |
| FDA SRS | X2MM4WR3KL |
| PubChem | 90308 |
| ChemSpider | 81530.0 |