| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | B46YS921BY |
| EPA CompTox | DTXSID9020588 |
Structure
| InChI Key | ULXKXLZEOGLCRJ-BYPYZUCNSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H11N1O2S1 |
| Molecular Weight | 149.05 |
| AlogP | 0.15 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 63.32 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2629-59-6 |
| NORMAN SUSDAT | |
| FDA SRS | B46YS921BY |
| PubChem | 92185 |
| ChemSpider | 83227.0 |
CONTENTS
