Lipophilicity
Benchmarks
TaskDatasetSOTA resultTrendResults
Lipophilicity
0.599RMSE
54
Lipophilicity
3.61Alpha (α)
20
Lipophilicity random 6:2:2 (test)
0.745RMSE
17
Lipophilicity (scaffold)
0.6RMSE
12
Lipophilicity AstraZeneca (train test)
0.75RMSE
8
Lipophilicity
0.904Final HV
6
Lipophilicity Small-dataset CliffSplit
0.474Q1 Score
5
Lipophilicity (random split)
0.555RMSE
5
Lipophilicity MoleculeNet scaffold (test)
0.932RMSE
2