Name

化合物结构

范德华力

(kcal/mol)

静电势能

(kcal/mol)

溶剂化作用

(kcal/mol)

非极性溶剂化作用

(kcal/mol)

ZINC000248240127

−61.8503

1.9303

10.3824

−6.5398

ZINC000252462409

−60.3752

−2.1143

16.0291

−6.1140

ZINC000253497611

−55.1539

1.0019

8.4986

−5.5613

ZINC000257349893

−55.3001

−0.4856

13.2185

−5.7725

VD₃

−48.3288

−3.8471

15.8063

−6.1617