| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID2064280 |
| InChI Key | LSCZRKJYCZGWDE-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C36H19N3O5S1 |
| Molecular Weight | 605.1 |
| AlogP | 6.73 |
| Hydrogen Bond Acceptor | 8.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 139.78 |
| Heavy Atoms | 45.0 |