Table 4.
Compounds | Class | Class Predicted SAR | pMIC | pMIC Predicted | Experimental MIC | QSAR Predicted MIC | Class Predicted QSAR |
---|---|---|---|---|---|---|---|
Neobavaisoflavone | B | A1 | −1.3 | −1.61 | 20.0 | 40.7 | C |
Dihydroauriculatin | B | A4 | −1.15 | −0.99 | 14.1 | 9.8 | A |
Eryvarin C | B | A4 | −1.27 | −1.44 | 18.6 | 27.5 | C |
Erystagallin A | B | B1 | −1.04 | −1.27 | 11.0 | 18.6 | B |
Eryzerin E | B | B1 | −1.19 | −1.27 | 15.5 | 18.6 | B |
Orientanol C | B | B1 | −1.19 | −1.65 | 15.5 | 44.7 | C |
Eryvarin V | B | B1 | −1.27 | −1.22 | 18.6 | 16.6 | B |
5−Hydroxysophoranone | B | B2 | −1.1 | −0.93 | 12.6 | 8.5 | A |
Abyssinone IV | B | B2 | −1.1 | −1.25 | 12.6 | 17.8 | B |
Erybraedin C | B | B3 | −1.1 | −1.03 | 12.6 | 10.7 | A |
Eryvarin D | B | B3 | −1.1 | −0.98 | 12.6 | 9.5 | A |
Ptorepterocarpan | B | B3 | −1.1 | −0.99 | 12.6 | 9.8 | A |
Eryzerin A | B | B3 | −1.27 | −1.25 | 18.6 | 17.8 | B |
Phaseollidin | B | B3 | −1.39 | −1.12 | 24.5 | 13.2 | B |
Eryvarin Y | B | B4 | −1.27 | −1.23 | 18.6 | 17.0 | B |
Citflavanone | B | B5 | −1.1 | −1.74 | 12.6 | 55.0 | C |
Glabrocoumarone A | B | B5 | −1.1 | −1.2 | 12.6 | 15.8 | B |
Erybraedin B | B | C4 | −1.1 | −1.04 | 12.6 | 11.0 | B |
Lupinifolin | B | D4 | −1.1 | −1.72 | 12.6 | 52.5 | C |