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“The Science and Business of Medicinal Chemistry” was developed to provide nonscience majors with an in-depth perspective into the pharmaceutical industry. As a lecture course with a laboratory component, topics discussed include an introduction to the basic concepts of medicinal chemistry, such as drug discovery, development, and commercialization; a discussion of chemical bonding and the organic functional groups found in drug molecules; and an examination of the physiochemical properties related to drug action. Student scientific literacy of the public policy debates surrounding the pharmaceutical industry and the commercialization of science was enhanced through class discussions and group-based projects. The details of this course, its implementation, and assessment are discussed.

While structures and reactivities of many small molecules can be computed efficiently and accurately using quantum chemical methods, heuristic approaches remain essential for modeling complex structures and large-scale chemical systems. Here, we present a heuristics-aided quantum chemical methodology applicable to complex chemical reaction networks such as those arising in cell metabolism and prebiotic chemistry. Chemical heuristics offer an expedient way of traversing high-dimensional reactive potential energy surfaces and are combined here with quantum chemical structure optimizations, which yield the structures and energies of the reaction intermediates and products. Application of heuristics-aided quantum chemical methodology to the formose reaction reproduces the experimentally observed reaction products, major reaction pathways, and autocatalytic cycles.