Pubchemid | SP score | XP score | Emodel | Glide energy | Evdw | Ecoul |
---|---|---|---|---|---|---|
178749 | -14.00 | -14.02 | -55.19 | -101.78 | -27.11 | -103.71 |
4200706 | -12.47 | -12.50 | -38.07 | -83.45 | -4.36 | -83.01 |
16752671 | -11.79 | -12.46 | 10000.00 | -47.57 | -25.11 | -75.10 |
46173525 | -11.68 | -12.36 | 10000.00 | -43.96 | -4.36 | -63.20 |
46173281 | -11.68 | -12.36 | 10000.00 | -43.96 | -32.28 | -63.20 |
107758 | -11.51 | -12.22 | -116.22 | -80.52 | -10.61 | -73.76 |
21099914 | -12.19 | -12.21 | 10000.00 | -49.63 | -25.73 | -81.18 |
890 | -11.93 | -11.96 | 10000.00 | -63.94 | -14.24 | -57.45 |
57773931 | -11.14 | -11.83 | -43.24 | -85.29 | -6.11 | -79.26 |
53380198 | -11.77 | -11.80 | 10000.00 | -29.84 | -18.00 | -75.21 |