Table 1. Names, formulas, and chemical properties of sixteen compounds tested in this study.
| Compounds | MWu | logPv | HBDw | HBAx | NRBy | TPSAz |
|---|---|---|---|---|---|---|
| C16 | 337 | 3.5 | 2 | 4 | 2 | 83.6 |
| C17 | 436 | 5.0 | 2 | 6 | 3 | 103.9 |
| C18 | 420 | 3.5 | 2 | 6 | 6 | 111.0 |
| C19 | 384 | 4.7 | 2 | 4 | 4 | 79.9 |
| C20 | 400 | 3.9 | 2 | 2 | 3 | 58.2 |
| SA1 | 526 | 4.6 | 1 | 10 | 8 | 111.0 |
| SA2 | 364.4 | 5.01 | 2 | 4 | 3 | 80 |
| SA3 | 510 | 5.0 | 1 | 9 | 7 | 102.0 |
| SA4 | 400.4 | 1.93 | 2 | 8 | 6 | 101 |
| SA5 | 364.4 | 1.89 | 2 | 8 | 6 | 101 |
| SA6 | 394.5 | 5.12 | 2 | 4 | 3 | 58 |
| SA7 | 500.6 | 6.74 | 2 | 5 | 5 | 67 |
| SA8 | 486.6 | 6.21 | 3 | 5 | 4 | 78 |
| SA9 | 438.5 | 5.56 | 2 | 5 | 5 | 67 |
| SA10 | 476.6 | 6.31 | 3 | 5 | 3 | 78 |
| SA11 | 466.6 | 6.04 | 2 | 4 | 4 | 58 |
u MW = molecular weight
v logP = oil/water distribution coefficient
w HBD = hydrogen bond donors
x HBA = hydrogen bond acceptor
y NRB = number of rotatable bonds
z tPSA = topological polar surface area.