Ring systems in medicinal chemistry: A cheminformatics analysis of ring popularity in drug discovery over time
Peter Ertl, Eva Altmann, Rainer Wilcken
Topics & Concepts
CheminformaticsChemistryDrug discoveryChemical spaceRing (chemistry)Combinatorial chemistryStereochemistryMoleculeRetrosynthetic analysisDrug developmentSmall moleculeDrugPopularityComputational biologyNanotechnologyBenzazepineKey (lock)Hydrogen bondComponent (thermodynamics)Chemical synthesischEMBLMolecular descriptorMolecular conformationQuantitative structure–activity relationshipComputational chemistryComputational Drug Discovery MethodsGenetics, Bioinformatics, and Biomedical Research