Table 3. Binding Scores of the Newly Prepared Compounds and Dox to 6ENV-MCV-7, 4b3z-Lung, and HepG2-2JW2.

	binding score (kcal/mol)
comp.	6ENV-MCV-7	4b3z-lung	HepG2–2JW2
1	–5.47951	–5.19771	–4.89862
2	–6.25608	–5.88317	–5.49264
3	–5.8625	–5.50277	–5.5669
4a	–5.83893	–5.40306	–5.16215
4b	–5.77245	–5.42736	–5.11563
6	–5.82066	–5.69825	–5.14694
7	–5.94382	–6.17619	–5.43515
11	–6.13866	–5.80001	–5.29499
13	–6.0665	–6.03983	–5.4955
14	–6.22066	–6.21129	–5.43210
15	–5.69644	–5.6829	–5.59437
17	–6.5531	–6.12329	–5.59266
18	–5.72812	–5.17581	–5.26642
19	–6.11341	–6.33115	–5.95474
Dox.	–8.1865	–7.2391	–6.61660