| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | FKX45W2SYT |
| EPA CompTox | DTXSID90166129 |
Structure
| InChI Key | BZFIPFGRXRRZSP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H9N1S1 |
| Molecular Weight | 127.05 |
| AlogP | 2.27 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 12.89 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 15679-10-4 |
| NORMAN SUSDAT | |
| FDA SRS | FKX45W2SYT |
| PubChem | 85054 |
| ChemSpider | 76719.0 |
CONTENTS
