(A1) Chemical structure of the B73aIII (A2) Bioavailability radar diagram of the B73aIII, (A3) ‘BOILED-Egg’ images of the B73aIII in SwissADME software, (B1)Chemical structure of the ligand B73aV, (B2) Bioavailability radar diagram of the B73aV, (B3) ‘BOILED-Egg’ images of the B73aV in SwissADME software, (C1) Chemical structure of the cocrystal ligand EST, (C2) Bioavailability radar diagram of the EST, (C3) ‘BOILED-Egg’ images of the EST in SwissADME software. (Boiled-egg images indicate BBB (Blood-Brain barrier) permeability, HIA (gastrointestinal absorption), PGP+ and PGP- (P glycoprotein)).