| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID6067466 |
| InChI Key | AGNWOVTXIOJMKI-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C22H26N4O8S1 |
| Molecular Weight | 506.15 |
| AlogP | 3.65 |
| Hydrogen Bond Acceptor | 11.0 |
| Number of Rotational Bond | 11.0 |
| Polar Surface Area | 157.84 |
| Heavy Atoms | 35.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 29426-52-6 |
| NORMAN SUSDAT | |
| PubChem | 122374 |
| ChemSpider | 109111.0 |