Table 5.
Compounds | Class | Class Predicted SAR | pMIC | pMIC Predicted | Experimental MIC | QSAR Predicted MIC | Class Predicted QSAR |
---|---|---|---|---|---|---|---|
Orobol | C | A1 | −1.93 | −1.61 | 85.1 | 40.7 | C |
Eryvarin Z | C | B4 | −1.57 | −1.19 | 37.2 | 15.5 | B |
Eryravin L | C | C1 | −1.4 | −1.63 | 25.1 | 42.7 | C |
Demethylmedicarpin | C | C1 | −1.7 | −1.54 | 50.1 | 34.7 | C |
Erypoegin A | C | C2 | −1.4 | −1.21 | 25.1 | 16.2 | B |
Eryvarin E | C | C2 | −1.4 | −0.97 | 25.1 | 9.3 | A |
Sandwicensin | C | C2 | −1.47 | −1.15 | 29.5 | 14.1 | B |
Abyssinone−V 4−O−methyl ether | C | C2 | −1.65 | −1.61 | 44.7 | 40.7 | C |
Lysisteisoflavone | C | C2 | −1.79 | −1.6 | 61.7 | 39.8 | C |
Eryzerin B | C | C2 | −1.8 | −1.7 | 63.1 | 50.1 | C |
Glabrol | C | C3 | −1.47 | −1.15 | 29.5 | 14.1 | B |
Erysubin F | C | C3 | −1.7 | −1.47 | 50.1 | 29.5 | C |
Folitenol | C | C4 | −1.45 | −1.18 | 28.2 | 15.1 | B |
Alpinumisoflavone | C | C4 | −1.48 | −1.57 | 30.2 | 37.2 | C |
Erythbidin A | C | C4 | −1.5 | −1.33 | 31.6 | 21.4 | B |
Glyasperin F | C | C4 | −1.5 | −2.14 | 31.6 | 138.0 | D |
Phaseolin | C | C4 | −1.57 | −1.72 | 37.2 | 52.5 | C |
Prenyl costarone | C | D3 | −1.61 | −1.82 | 40.7 | 66.1 | C |