| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 6056O8W6ET |
| EPA CompTox | DTXSID9021346 |
Structure
| InChI Key | BRWIZMBXBAOCCF-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C1H5N3S1 |
| Molecular Weight | 91.02 |
| AlogP | -0.69 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 4.0 |
| Polar Surface Area | 61.9 |
| Heavy Atoms | 5.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 79-19-6 |
| NORMAN SUSDAT | |
| FDA SRS | 6056O8W6ET |
| PubChem | 2723789 |
| ChemSpider | 2005980.0 |
CONTENTS
