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. 2012 Apr 25;7(4):e35792. doi: 10.1371/journal.pone.0035792

Table 6. Hit expansion for ligand 8.

ID IC50 [M] (SD)* Hill slope (SD)* Ligand efficiency [kcal/mol per non-hydrogen atom]
8 2.5·10−6 (4·10−7) 1.3 (0.1) 0.35
21 2.7·10−5 (9·10−6) 1.1 (0.3) 0.28
22 1.8·10−4 (4·10−5) 0.8 (0.1) 0.26
23 3.2·10−4 (8·10−5) 0.7 (0.1) 0.23
24 n.i.a - -
25 n.i. - -
26 n.i. - -
27 n.i. - -
28 n.i. - -
29 n.i. - -
30 n.i. - -

For chemical structures see Figure 16.

*

average values of three independent measurements, standard deviation in brackets.

a

no inhibition at solubility limit measured.