Table 1. Estimated binding affinities and calculated logP values for the compounds 3a-c, 5, and FPF.
Compound | Predicted binding affinity, kJ/mol | logP |
---|---|---|
3a | -33.472 | 4.42 |
3b | -35.146 | 3.65 |
3c | -34.727 | 4.53 |
5 | -30.125 | 2.94 |
FPF | -29.288 | 1.84 |
P = partition coefficient