| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID80198035 |
Structure
| InChI Key | SDNXQWUJWNTDCC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C3H9N1O2S1 |
| Molecular Weight | 123.04 |
| AlogP | -1.01 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 60.16 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 49773-20-8 |
| NORMAN SUSDAT | |
| PubChem | 4340561 |
| ChemSpider | 3544585.0 |
CONTENTS
