| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | HXX5LM4J4E |
| EPA CompTox | DTXSID30218696 |
| InChI Key | JYRXPFCUABYLPD-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C6H13N1S2 |
| Molecular Weight | 163.05 |
| AlogP | 1.98 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 3.24 |
| Heavy Atoms | 9.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 686-07-7 |
| NORMAN SUSDAT | |
| FDA SRS | HXX5LM4J4E |
| PubChem | 12704 |
| ChemSpider | 12182.0 |