| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | WW8M82QUP5 |
| EPA CompTox | DTXSID9060570 |
Structure
| InChI Key | JIZRGGUCOQKGQD-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H3N1O2S1 |
| Molecular Weight | 128.99 |
| AlogP | 1.66 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 43.14 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 609-40-5 |
| NORMAN SUSDAT | |
| FDA SRS | WW8M82QUP5 |
| PubChem | 11866 |
| ChemSpider | 11373.0 |
CONTENTS
