| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 73Y7P0K73Y |
| EPA CompTox | DTXSID7025508 |
Structure
| InChI Key | AGBQKNBQESQNJD-SSDOTTSWSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H14O2S2 |
| Molecular Weight | 206.04 |
| AlogP | 2.79 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 37.3 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 1077-28-7 |
| NORMAN SUSDAT | |
| FDA SRS | 73Y7P0K73Y |
| PubChem | 6112 |
CONTENTS
