Table 7.
Correlation equations and statistical parameters describing the relationships between logPTLC and other data obtained.
| Parameter | Equation | r | s | F | P |
|---|---|---|---|---|---|
| iLOGP | LogPTLC = 1.606 (±0.296) iLOGP − 0.584 (±1.523) | 0.953 | 0.319 | 29 | 0.01 |
| XLOGP2 | LogPTLC = 0.699 (±0.095) XLOGP2 + 0.662 (±0.951) | 0.974 | 0.239 | 55 | 0.00 |
| XLOGP3 | LogPTLC = 0.742 (±0.098)XLOGP3 − 0.042 (±1.025) | 0.974 | 0.235 | 57 | 0.00 |
| WLOGP | LogPTLC = 0.751 (±0.100) WLOGP + 0.852 (±0.907) | 0.975 | 0.234 | 57 | 0.00 |
| MLOGP | LogPTLC = 2.529 (±0.368) MLOGP − 9.011 (±2.425) | 0.970 | 0.256 | 47 | 0.01 |
| SILICOS-IT | LogPTLC = 0.691 (±0.093) SILICOS-IT+1.802 (±0.795) | 0.974 | 0.238 | 55 | 0.00 |
| MilogP | LogPTLC = 1.029 (±0.186) milogP − 1.253 (±1.618) | 0.954 | 0.314 | 30 | 0.01 |
| ACD/logP | LogPTLC = 0.612 (±0.085) ACD/logP + 0.624 (±0.976) | 0.972 | 0.244 | 52 | 0.01 |
| KOWWIN | LogPTLC = 0.637 (±0.097) KOWWIN + 0.970 (±1.019) | 0.967 | 0.266 | 43 | 0.01 |
| ALOGPs | LogPTLC = 1.1415 (±0.147) ALOGPs + 0.065 (±0.982) | 0.978 | 0.228 | 60 | 0.00 |
| M | LogPTLC = 0.011 (±0.001) M + 1.362 (±0.839) | 0.975 | 0.234 | 57 | 0.00 |
| TPSA | LogPTLC = 0.077 (±0.010) TPSA + 3.016 (±0.623) | 0.975 | 0.235 | 57 | 0.00 |
| nROTB | LogPTLC = 0.354 (±0.059) nROTB + 5.507 (±0.379) | 0.961 | 0.291 | 36 | 0.01 |
| nHBA | LogPTLC = 0.978 (±0.270) nHBA + 4.513 (±0.889) | 0.902 | 0.453 | 13 | 0.04 |
| MR | LogPTLC = 0.038 (±0.005) MR + 0.928 (±0.911) | 0.974 | 0.238 | 55 | 0.00 |
| LogPapp | LogPTLC = −2.619 (±0.661) logPapp + 9.761 (±0.567) | 0.916 | 0.419 | 16 | 0.03 |
| LogKp | LogPTLC = 34.913 (±5.572) logKp + 103.458 (±15.294) | 0.964 | 0.279 | 39 | 0.01 |