| Keyword(s): | Human Metabolites |
| Molecule Category | Salt-form |
| EPA CompTox | DTXSID0072221 |
| InChI Key | QOJOEFSUDMHIOC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C39H50N12O4S1 |
| Molecular Weight | 782.38 |
| AlogP | 6.06 |
| Hydrogen Bond Acceptor | 13.0 |
| Hydrogen Bond Donor | 5.0 |
| Number of Rotational Bond | 19.0 |
| Polar Surface Area | 208.25 |
| Heavy Atoms | 56.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 71032-95-6 |
| NORMAN SUSDAT | |
| ChemSpider | 7851151.0 |