Table 2.
Two-dimensional representations of compounds retrieved from the IBScreen database.
Compounds | IBScreen ID | Structures | Binding energies (kcal/mol) |
---|---|---|---|
a | STOCK4S-95238 |
![]() |
-7.842 |
b | STOCK1S-15990 |
![]() |
-10.498 |
c | STOCK6S-14477 |
![]() |
-10.083 |
d | STOCK3S-48351 |
![]() |
-8.014 |
e | STOCKIS-43560 |
![]() |
-8.350 |