Table 3 Summary of mean values for selected properties of compounds from the different collections.
Collection | Mean heavy atoms | Mean cLogP | Mean fraction Csp3 | Mean total polar surface area | Mean number of rotatable bonds |
|---|---|---|---|---|---|
ADEL | 51.83 | 1.92 | 0.39 | 141.35 | 15.09 |
LDC | 25.12 | 3.14 | 0.30 | 78.61 | 4.94 |
eDESIGNER_2 | 28.38 | 2.53 | 0.48 | 102.02 | 9.59 |
eDESIGNER_3 | 30.24 | 1.97 | 0.59 | 114.36 | 11.23 |