| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | PWQ9TX5PQU |
Structure
| InChI Key | BBYPDHMUWHQEAO-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H9N1O1S1 |
| Molecular Weight | 155.04 |
| AlogP | 1.91 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 29.96 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 233665-91-3 |
| NORMAN SUSDAT | |
| FDA SRS | PWQ9TX5PQU |
CONTENTS
