TABLE 2.

The 3D-QSAR model’s predicted activity pIC50 (Pred).

Compounds	Structures	Activity estimated pIC50		Binding affinity (Kcal/mol)
		CoMFA	CoMSIA
T01		6.430	6.594	−9.6
T02		6.182	6.263	−9.7
T03		6.166	6.502	−10
T04		6.357	6.614	−8.9
T05		5.808	6.482	−9.8
T06		6.136	6.368	−10
22		5.83	5.82	−8.8