Calculated binding energies of active oxadiazoles with 14 cytochrome P450 (14 α-sterol demethylase, CYP51).
| Compound | Binding affinity (kcal mol−1) | |
|---|---|---|
| C. albicans CYP51 (PDB: 5FSA) | Human CYP34A (PDB: 4D7D) | |
| UOSO10 | −8.5 | −5.9 |
| UOSO12 | −8.4 | −5.4 |
| UOSO13 | −9.3 | −4.9 |
| UOSO14 | −8.9 | −5.3 |
| Fluconazole | −6.7 | −7.1 |