| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 1B27G5W046 |
| EPA CompTox | DTXSID70864696 |
Structure
| InChI Key | NCBDFIPMWRKPDU-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H10OS |
| Molecular Weight | 118.05 |
| AlogP | 1.33 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 17.07 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 16630-52-7 |
| NORMAN SUSDAT | |
| FDA SRS | 1B27G5W046 |
| PubChem | 61845 |
CONTENTS
