Table 10 The medicinal chemistry friendliness filters for curcumin, trans-resveratrol, quercetin and (1 s,4 s)-eucalyptol
|  | Curcumin | Trans-resveratrol | Quercetin | (1 s,4 s)-Eucalyptol |
|---|---|---|---|---|
PAINS | 0 alert | 0 alert | 1 alert: catechol | 0 alert |
Brenk | 2 alerts: beta_keto_anhydride, michael_acceptor_1 | 1 alert: stilbene | 1 alert: catechol | 0 alert |
Leadlikeness | No; 2 violations: MW > 350, Rotors> 7 | No; 1 violation: MW < 250 | Yes | No; 1 violation: MW < 250 |
Synthetic accessibility | 2.97 | 2.02 | 3.23 | 3.65 |