| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID70194526 |
Structure
| InChI Key | WTCUHYRXLIHSLY-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H8N2O3S1 |
| Molecular Weight | 164.03 |
| AlogP | -0.82 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 69.97 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 41730-79-4 |
| NORMAN SUSDAT | |
| PubChem | 3016296 |
| ChemSpider | 2284260.0 |
CONTENTS
