| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | Z63G378ME6 |
| EPA CompTox | DTXSID9062720 |
Structure
| InChI Key | MXTPRJXPLFGHEE-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C2H7N1O3S2 |
| Molecular Weight | 156.99 |
| AlogP | -0.52 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 80.39 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2937-53-3 |
| NORMAN SUSDAT | |
| FDA SRS | Z63G378ME6 |
| PubChem | 76242 |
| ChemSpider | 68722.0 |
CONTENTS
