Table 3.
Entry | Species | Source of clogP | Compound class | n | r2 | m | c |
---|---|---|---|---|---|---|---|
1a | Human | Cerius2 (version 4.6) | Uncharged | 78 | 0.63 | 0.449 | −0.416 |
2a | Human | Cerius2 (version 4.6) | Positively charged | 63 | 0.67 | 0.463 | −1.097 |
3b | Human | ACD | Neutral/basic | 15 | 0.430 | 0.351 | −0.834 |
4b | Monkey | ACD | Neutral/basic | 17 | 0.574 | 0.407 | −0.268 |
5b | Human | Pallas 3.0 | Neutral/basic | 15 | 0.385 | 0.461 | −0.067 |
6b | Monkey | Pallas 3.0 | Neutral/basic | 17 | 0.519 | 0.504 | −0.571 |
From Ref. 18.
From this study.