Table S4.

Binding affinity of the studied compounds

No	pIC50	Binding affinity (Kcal/mol)	No	pIC50	Binding affinity (Kcal/mol)
8b	6.5968	−9.4	11g	6.2048	−9.4
9a	6.1007	−9.5	12b	5.5497	−8.5
9b	5.6740	−9.5	15a	5.2232	−7.9
10a	6.3269	−9.2	15b	5.2831	−8.1
10b	7.7958	−9.9	16a	5.4723	−8.5
10c	6.8386	−9.6	16b	5.3106	−8.3
10d	6.70114	−9.3	16c	6.5482	−9.4
10e	7.2518	−9.7	17a	6.2365	−9.1
10f	7.1611	−9.6	18a	6.6516	−9.2
10g	6.3777	−9.3	19a	5.2306	−8.3
10h	5.8551	−9.3	20a	5.5867	−8.7
11a	6.7399	−9.4	20b	6.0282	−9.2
11b	7.2441	−9.5