| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID90223721 |
Structure
| InChI Key | JOSVHNVOXNQDTB-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H15N1S2 |
| Molecular Weight | 165.06 |
| AlogP | 1.43 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 26.02 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 73502-96-2 |
| NORMAN SUSDAT | |
| PubChem | 20521802 |
CONTENTS
