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. Author manuscript; available in PMC: 2012 Jan 1.
Published in final edited form as: Bioorg Med Chem. 2010 Nov 26;19(1):91–101. doi: 10.1016/j.bmc.2010.11.049

Table 3.

Analogs based on virtual screening via docking

Compd R1 R2 Ring n IC50 (μM) Kd (μM) Activation of viral infectivity
21 Cl F graphic file with name nihms256901t21.jpg 5 58 ± 18.6 3.3 0.5 ± 0.2
22 Cl F graphic file with name nihms256901t22.jpg 1 >100.0 4.2 0.7 ± 0.3
23 Cl F graphic file with name nihms256901t23.jpg 1 >100.0 2.5 0.3
24 Cl F graphic file with name nihms256901t24.jpg 1 >100.0 ND 0.0
25 Cl F graphic file with name nihms256901t25.jpg 1 27 2.3 0.0
26 Cl F graphic file with name nihms256901t26.jpg 1 >100 ND 0.0
27 Cl F graphic file with name nihms256901t27.jpg 1 >100.0 ND 0.0
28 Cl F graphic file with name nihms256901t28.jpg 1 >100.0 ND 0.0
29 Cl F graphic file with name nihms256901t29.jpg 1 >100 ND 0.1