| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | WQY39AV49E |
| EPA CompTox | DTXSID50167253 |
Structure
| InChI Key | BDTDECDAHYOJRO-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H5N1O2S1 |
| Molecular Weight | 131.0 |
| AlogP | 1.25 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 38.66 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 16182-04-0 |
| NORMAN SUSDAT | |
| FDA SRS | WQY39AV49E |
| PubChem | 85320 |
| ChemSpider | 76949.0 |
CONTENTS
