Concepedia

Quantitative structure-activity relationship study and directed synthesis of Thieno[2,3-d]pyrimidine-2,4-diones as monocarboxylate transporter 1 inhibitors

Oleg Devinyak, Mikh. V. Slivka, Mar. V. Slivka, Vladimir Vais

Medicinal Chemistry Research · 2011 · 11 citations · 18 references

Concepts

PharmacyMedicinal ChemistryPharmacologyDrug DesignDrug DiscoveryStructure-activity RelationshipsHit-to-lead OptimizationLead Compound DesignLigand-based DesignPotency OptimizationStereochemical OptimizationStructure-activity Relationship AnalysisChemical Synthesis Of AnaloguesPyrimidine AnalogsPyrimidine AnaloguesStructure - Activity Relationship OptimizationStructure-activity Relationship Guided Design

References

18

Applied Regression Analysis

Technometrics · 2005 · 18.1K citations

Business, Biostatistics, Mathematics +17

Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings

Christopher A. Lipinski, Franco Lombardo, Beryl W. Dominy et al. · Advanced Drug Delivery Reviews · 1997 · 11.2K citations

Pharmacy, Pharmacokinetics, Pharmacology +16

Iterative partial equalization of orbital electronegativity—a rapid access to atomic charges

Johann Gasteiger, Mario Marsili · Tetrahedron · 1980 · 4.1K citations

Natural Sciences, Chemistry, Physics +10

Applied Regression Analysis

Richard F. Gunst, Norman R. Draper, Harry Smith · Technometrics · 1999 · 3.8K citations

Principles of QSAR models validation: internal and external

Paola Gramatica · QSAR & Combinatorial Science · 2007 · 2.2K citations · Full text

Pharmacy, Medicinal Chemistry, Drug Design +13