| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 2J031W0YZI |
| EPA CompTox | DTXSID10236979 |
Structure
| InChI Key | SEHSPJCWCBQHPF-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H9Cl1O5S2 |
| Molecular Weight | 235.96 |
| AlogP | -0.43 |
| Hydrogen Bond Acceptor | 5.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 77.51 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 88343-72-0 |
| NORMAN SUSDAT | |
| FDA SRS | 2J031W0YZI |
CONTENTS
