| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID0024509 |
Structure
| InChI Key | DYCLHZPOADTVKK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H6N2O2S1 |
| Molecular Weight | 158.01 |
| AlogP | 0.18 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 76.94 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 29676-71-9 |
| NORMAN SUSDAT | |
| ChemSpider | 31903.0 |
CONTENTS
