Extended Data Fig. 2 |. Synthesis and ADME study of p-38 kinase inhibitor 116 and its BCP analogue 115.

The BCP analogue 115 of arene 116, a p-38 kinase inhibitor⁶⁵, was prepared via the selective functionalization sequence: 1) cyanation; 2) hydrolysis and esterification; 3) arylation; 4) hydrolyses and amide couplings. The physicochemical and ADME properties for both compounds were profiled. Fsp³, the fraction of sp³ carbon atoms; Log D, distribution coefficient; Solubility, high-throughput equilibrium solubility; MDCKII, Madin-Darby canine kidney cells; Papp, apparent permeability.