All Stories

  1. Expediting hit-to-lead progression in drug discovery through reaction prediction and multi-dimensional optimization
  2. Optimization of a DNA encoded library derived autotaxin inhibitor hit to a potent in vivo LPA lowering quinazolinone compound with a non‑zinc binding mode
  3. Simple User‐Friendly Reaction Format
  4. Accelerating compound synthesis in drug discovery: the role of digitalisation and automation
  5. Enhancing Drug Discovery and Development through the Integration of Medicinal Chemistry, Chemical Biology, and Academia-Industry Partnerships: Insights from Roche’s Endocannabinoid System Projects
  6. RG7774 (Vicasinabin), an orally bioavailable cannabinoid receptor 2 (CB2R) agonist, decreases retinal vascular permeability, leukocyte adhesion, and ocular inflammation in animal models
  7. Simple User-Friendly Reaction Format
  8. sp3‐Rich Heterocycle Synthesis on DNA: Application to DNA‐Encoded Library Production
  9. sp3‐Rich Heterocycle Synthesis on DNA: Application to DNA‐Encoded Library Production
  10. Geometric deep learning-guided Suzuki reaction conditions assessment for applications in medicinal chemistry
  11. Enabling late-stage drug diversification by high-throughput experimentation with geometric deep learning
  12. Identifying opportunities for late-stage C-H alkylation with high-throughput experimentation and in silico reaction screening
  13. Investigations into mRNA Lipid Nanoparticles Shelf-Life Stability under Nonfrozen Conditions
  14. Development and Demonstration of a High-Volume Manufacturing Process for a Key Intermediate of Dalcetrapib: Investigations on the Alkylation of Carboxylic Acids, Esters, and Nitriles
  15. Simple User-Friendly Reaction Format
  16. Diligent Design Enables Antibody-ASO Conjugates with Optimal Pharmacokinetic Properties
  17. Graph transformer neural network for chemical reactivity prediction
  18. Rapid 18F‐ and 19F‐Difluoromethylation via Desulfurative Fluorination of Transient N‐, O‐, and C‐Linked Dithioles
  19. Enabling late-stage drug diversification by high-throughput experimentation with geometric deep learning
  20. Late-stage Functionalization and its Impact on Modern Drug Discovery
  21. Antagonizing somatostatin receptor subtype 2 and 5 reduces blood glucose in a gut- and GLP-1R-dependent manner
  22. Quaternary Ammonium Trifluoromethoxide Salts as Stable Sources of Nucleophilic OCF3
  23. Paracrine crosstalk between intestinal L- and D-cells controls secretion of glucagon-like peptide-1 in mice
  24. Modulation of Pharmacologically Relevant Properties of Piperidine Derivatives by Functional Groups in an Equatorial or Axial β‐Position to the Amino Group
  25. A Convenient Synthesis of Difluoroalkyl Ethers from Thionoesters using Silver(I) Fluoride
  26. Electrostatic Effects Accelerate Decatungstate-Catalyzed C–H Fluorination Using [18F]- and [19F]NFSI in Small Molecules and Peptide Mimics
  27. 18F-Branched-Chain Amino Acids: Structure–Activity Relationships and PET Imaging Potential
  28. Site-Selective, Late-Stage C−H 18 F-Fluorination on Unprotected Peptides for Positron Emission Tomography Imaging
  29. Site-Selective, Late-Stage C−H 18 F-Fluorination on Unprotected Peptides for Positron Emission Tomography Imaging
  30. A carbohydrate-derived trifunctional scaffold for medicinal chemistry library synthesis
  31. 2H-1,2,3-Triazole-Based Dipeptidyl Nitriles: Potent, Selective, and Trypanocidal Rhodesain Inhibitors by Structure-Based Design
  32. Direct heterobenzylic fluorination, difluorination and trifluoromethylthiolation with dibenzenesulfonamide derivatives
  33. Synthesis of acyl fluorides via photocatalytic fluorination of aldehydic C–H bonds
  34. A carbohydrate-derived trifunctional scaffold for DNA-encoded libraries
  35. Prospective Evaluation of Free Energy Calculations for the Prioritization of Cathepsin L Inhibitors
  36. 18F-Fluorination of Unactivated C–H Bonds in Branched Aliphatic Amino Acids: Direct Synthesis of Oncological Positron Emission Tomography Imaging Agents
  37. Intramolecular Inverse Electron-Demand [4 + 2] Cycloadditions of Ynamides with Pyrimidines: Scope and Density Functional Theory Insights
  38. A Convenient Late-Stage Fluorination of Pyridylic C−H Bonds with N -Fluorobenzenesulfonimide
  39. Going with the flow
  40. Inverse Electron-Demand [4 + 2]-Cycloadditions of Ynamides: Access to Novel Pyridine Scaffolds
  41. Synthesis of annulated pyridines as inhibitors of aldosterone synthase (CYP11B2)
  42. Discovery of 4-Aryl-5,6,7,8-tetrahydroisoquinolines as Potent, Selective, and Orally Active Aldosterone Synthase (CYP11B2) Inhibitors: In Vivo Evaluation in Rodents and Cynomolgus Monkeys
  43. Direct photocatalytic fluorination of benzylic C–H bonds with N-fluorobenzenesulfonimide
  44. A Convenient Photocatalytic Fluorination of Unactivated CH Bonds
  45. Inside Cover: Seamless Integration of Dose-Response Screening and Flow Chemistry: Efficient Generation of Structure-Activity Relationship Data of β-Secretase (BACE1) Inhibitors (Angew. Chem. Int. Ed. 6/2014)
  46. Seamless Integration of Dose-Response Screening and Flow Chemistry: Efficient Generation of Structure-Activity Relationship Data of β-Secretase (BACE1) Inhibitors
  47. Converting oxazoles into imidazoles: new opportunities for diversity-oriented synthesis
  48. Flow synthesis of annulated 5-aryl-substituted pyridines by tandem intramolecular inverse-electron-demand hetero-/retro-Diels–Alder reaction
  49. Discovery and optimisation of 1-hydroxyimino-3,3-diphenylpropanes, a new class of orally active GPBAR1 (TGR5) agonists
  50. The Kondrat’eva Reaction in Flow: Direct Access to Annulated Pyridines
  51. Cover Picture: 2-Phenoxy-nicotinamides are Potent Agonists at the Bile Acid Receptor GPBAR1 (TGR5) (ChemMedChem 4/2013)
  52. Photocatalytic Synthesis of Allylic Trifluoromethyl Substituted Styrene Derivatives in Batch and Flow
  53. 2-Phenoxy-nicotinamides are Potent Agonists at the Bile Acid Receptor GPBAR1 (TGR5)
  54. Evaluation of a flow-photochemistry platform for the synthesis of compact modules
  55. Scale-Up of Flow-Assisted Synthesis of C2-Symmetric Chiral PyBox Ligands
  56. Synthesis of Annulated Pyridines by Intramolecular Inverse-Electron-Demand Hetero-Diels-Alder Reaction under Superheated Continuous Flow Conditions
  57. Neighborhood-Preserving Visualization of Adaptive Structure-Activity Landscapes: Application to Drug Discovery
  58. G Protein-Coupled Receptor Transmembrane Binding Pockets and their Applications in GPCR Research and Drug Discovery: A Survey
  59. Synthesis of a Drug-Like Focused Library of Trisubstituted Pyrrolidines Using Integrated Flow Chemistry and Batch Methods
  60. Optimization of a novel class of benzimidazole-based farnesoid X receptor (FXR) agonists to improve physicochemical and ADME properties
  61. Discovery of novel and orally active FXR agonists for the potential treatment of dyslipidemia & diabetes
  62. Piperidinyl-nicotinamides as potent and selective somatostatin receptor subtype 5 antagonists
  63. Novel, non-peptidic somatostatin receptor subtype 5 antagonists improve glucose tolerance in rodents
  64. Benzoxazole piperidines as selective and potent somatostatin receptor subtype 5 antagonists
  65. Identification of an N-oxide pyridine GW4064 analog as a potent FXR agonist
  66. Synthesis of Light-Emitting Conjugated Polymers for Applications in Electroluminescent Devices
  67. Discovery of the First Nonpeptidic, Small-Molecule, Highly Selective Somatostatin Receptor Subtype 5 Antagonists: A Chemogenomics Approach
  68. From Astemizole to a Novel Hit Series of Small-Molecule Somatostatin 5 Receptor Antagonists via GPCR Affinity Profiling
  69. Predicting and Tuning Physicochemical Properties in Lead Optimization: Amine Basicities
  70. Remote Modulation of Amine Basicity by a Phenylsulfone and a Phenylthio Group
  71. Cyclopropanation of 3,4-dihydro-1 H-benzo[e][1,4]diazepine-2,5-diones
  72. Joint Meeting on Medicinal Chemistry in Vienna
  73. Ligand identification for G-protein-coupled receptors: a lead generation perspective
  74. Preparation of 5-amino-6-oxo-1,6-dihydro[1,2,4]triazine-3-carboxylic acid derivatives and synthesis of compound libraries thereof
  75. μSR in polymers
  76. Muon-spin relaxation study of anisotropic charge carrier motion in polyphenylene vinylene-based polymers
  77. Third-order nonlinear optical properties of in-backbone substituted conjugated polymers
  78. Anodic and Cathodic Electrochemically Generated Chemiluminescence in Conjugated Polymers
  79. New family of polyfluorene copolymers for light-emitting devices
  80. Multi-layer Polymer Light-emitting Diodes with 2,3-Dialkoxy-p-phenylene Vinylene and its Blends.
  81. White-light-continuum spectroscopy to determine third-order nonlinear optical properties
  82. Versatile synthesis of various conjugated aromatic homo- and copolymers
  83. Efficient electroluminescent poly(p-phenylene vinylene) copolymers for application in LEDs
  84. Polymer and small molecule multi-layer light-emitting diodes
  85. Electrochemiluminescence of conjugated polymer
  86. Muon-spin relaxation study of charge carrier dynamics in the conducting polymer PPV
  87. Ortho-Metallation as a key step for the synthesis of silyl substituted Poly(p-phenylenevinylene)s
  88. Insulated Molecular Wires: Dendritic Encapsulation of Poly(triacetylene) Oligomers, Attempted Dendritic Stabilization of Novel Poly(pentaacetylene) Oligomers, and an Organometallic Approach to Dendritic Rods
  89. New routes to monomers and polymers for LEDs
  90. Conjugated Oligomers and Polymers, Synthesis of
  91. Design of Luminescent Polymers for Leds
  92. Synthesis and Physical Investigation of Donor–Donor and Acceptor–Acceptor End-Functionalized Monodisperse Poly(triacetylene) Oligomers
  93. Monodisperse Poly(triacetylene) Oligomers Extending from Monomer to Hexadecamer: Joint Experimental and Theoretical Investigation of Physical Properties
  94. μSR of conducting and non-conducting polymers
  95. Synthesis of conjugated polymers for application in light-emitting diodes (PLEDs)
  96. The copolymer route to new luminescent materials for LEDs
  97. Efficient blue–green light emitting poly(1,4-phenylene vinylene) copolymers
  98. Synthesis of New Building Blocks for Light Emitting Polymers
  99. Synthesis of New Building Blocks for Light Emitting Polymers
  100. Scaling laws of second-order hyperpolarizabilities in molecular wires
  101. Design and synthesis of conjugated materials for efficient optoelectronic devices
  102. Scaling law for second-order hyperpolarizability in poly(triacetylene) molecular wires
  103. Modulation ofπ-Electron Conjugation in Oligo(triacetylene) Chromophores by Incorporation of a Central Spacer
  104. Linear Monodisperse π-Conjugated Oligomers: Model Compounds for Polymers and More
  105. Monodisperse Poly(triacetylene) Rods: Synthesis of a 11.9 nm Long Molecular Wire and Direct Determination of the Effective Conjugation Length by UV/Vis and Raman Spectroscopies
  106. PM3 geometry optimization and CNDO/S-CI computation of UV/Vis spectra of large organic structures: Program description and application to poly(triacetylene) hexamer and taxotere
  107. PM3 geometry optimization and CNDO/S-CI computation of UV/Vis spectra of large organic structures: Program description and application to poly(triacetylene) hexamer and taxotere
  108. Versatile Syntheses of Various Homo- and Copolymers of Poly(1,4-Arylene Vinylene)S
  109. Determination of End-to-End Distances in a Series of TEMPO Diradicals of up to 2.8 nm Length with a New Four-Pulse Double Electron Electron Resonance Experiment
  110. Determination of End-to-End Distances in a Series of TEMPO Diradicals of up to 2.8 nm Length with a New Four-Pulse Double Electron Electron Resonance Experiment
  111. Structure−Property Relationships in Third-Order Nonlinear Optical Chromophores
  112. Dendritic rods with a poly(triacetylene) backbone: insulated molecular wires
  113. Photochemical trans–cis isomerisation of donor/acceptor-substituted (E )-hex-3-ene-1,5-diynes (1,2-diethynylethenes, DEEs) and 3,4-diethynylhex-3-ene-1,5-diynes (tetraethynylethenes, TEEs)
  114. Poly(triacetylene) Oligomers: Synthesis, Characterization, and Estimation of the Effective Conjugation Length by Electrochemical, UV/Vis, and Nonlinear Optical Methods
  115. Electronic Characteristics of Arylated Tetraethynylethenes:  A Cooperative Computational and Electrochemical Investigation
  116. Functionalized One and Two-Dimensionally Conjugated Molecules for Thrid Order Nonlinear Optics