| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID8068418 |
| InChI Key | YPNBSXJSFUWYMV-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C18H19N5O8S1 |
| Molecular Weight | 465.1 |
| AlogP | 3.91 |
| Hydrogen Bond Acceptor | 12.0 |
| Number of Rotational Bond | 11.0 |
| Polar Surface Area | 166.84 |
| Heavy Atoms | 32.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 42783-06-2 |
| NORMAN SUSDAT | |
| PubChem | 162527 |
| ChemSpider | 142699.0 |