Fig. 3.
Geometric clash on some functional groups based on Medicinal Chemistry and Drug Likeness properties. Clash atoms indicated in oily red dots, A&B = Lamivudine reactive thiol, C = Tenofovir-disoproxil fumarate undesirable reactive conformer, D&E = Lenacapavir reactive thiol, F = Harpagide 5-O-β-D-glucopyranoside undesirable reactive conformer.