Characterisation of the water/o-nitrophenyl octyl ether system in terms of the partition of nonelectrolytes and of ions

Michael H. Abraham and Yuan H. Zhao

Phys. Chem. Chem. Phys., 2005, 7, 2418
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Quantitative Structure–Permeation Relationships for Solute Transport Across Silicone Membranes

Sandrine Geinoz, Sebastien Rey, Gilles Boss, Annette L. Bunge, Richard H. Guy, Pierre-Alain Carrupt, Marianne Reist and Bernard Testa

Pharm Res, 2002, 19, 1622
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Integrating Intramolecular Hydrogen Bonding (IMHB) Considerations in Drug Discovery Using ΔlogP As a Tool

Marina Shalaeva, Giulia Caron, Yuriy A. Abramov, Thomas N. O’Connell, Mark S. Plummer, Geeta Yalamanchi, Kathleen A. Farley, Gilles H. Goetz, Laurence Philippe and Michael J. Shapiro

J. Med. Chem., 2013, 56, 4870
DOI: 10.1021/jm301850m

The PAMPA technique as a HTS tool for partition coefficients determination in different solvent/water systems

Giorgio Ottaviani, Sophie Martel, Caroline Escarala, Edwige Nicolle and Pierre-Alain Carrupt

European Journal of Pharmaceutical Sciences, 2008, 35, 68
DOI: 10.1016/j.ejps.2008.06.006

The pH-Partition Profile of the Anti-Ischemic Drug Trimetazidine May Explain Its Reduction of Intracellular Acidosis

Frédéric Reymond, Guillaume Steyaert, Pierre-Alain Carrupt, Didier Morin, Jean-Paul Tillement, Hubert H. Girault and Bernard Testa

Pharm Res, 1999, 16, 616
DOI: 10.1023/A:1018899802836

Solvatochromic Analysis of Partition Coefficients in the o‐Nitrophenyl Octyl Ether (o‐NPOE)/Water System

Xiangli Liu, Géraldine Bouchard, Nathalie Müller, Alexandra Galland, Hubert Girault, Bernard Testa and Pierre‐Alain Carrupt

Helvetica Chimica Acta, 2003, 86, 3533
DOI: 10.1002/hlca.200390298

Electrochemical Estimation of Diffusion Anisotropy ofN,N,N′,N′-Tetramethyl-para-phenylenediamine within the Normal Hexagonal Lyotropic Mesophase of Triton X 100/Light Water: When Can the Effects of Cross-Pseudophase Electron Transfer be Neglected for Partitioned Reagents?

Jonathan E. Halls, Nathan S. Lawrence and Jay D. Wadhawan

J. Phys. Chem. B, 2011, 115, 6509
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Facilitated Transfer of Alkali and Alkaline‐Earth Metal Ions by a Calix[4]arene Derivative Across Water/1,2‐Dichloroethane Microinterface: Amperometric Detection of Ca2+

Haluk Bingol, Ferhat Kaykal, Emine G. Akgemci and Abdulkadir Sirit

Electroanalysis, 2010, 22, 2825
DOI: 10.1002/elan.201000345

Selective sodium ion transfer across a water/1,2-dichloroethane micro-interface by a calix[4]arene derivative

Ferhat Kaykal, Erdal Kocabas, Haluk Bingol, Emine G. Akgemci and Ahmet Coskun

Journal of Electroanalytical Chemistry, 2011, 654, 96
DOI: 10.1016/j.jelechem.2011.01.019

Determination of alkane/water partition coefficients of polar compounds using hydrophilic interaction chromatography

Bruno Bard, Pierre-Alain Carrupt and Sophie Martel

Journal of Chromatography A, 2012, 1260, 164
DOI: 10.1016/j.chroma.2012.08.094

Universal Model Based on the Mobile Order and Disorder Theory for Predicting Lipophilicity and Partition Coefficients in All Mutually Immiscible Two-Phase Liquid Systems

Paul Ruelle

J. Chem. Inf. Comput. Sci., 2000, 40, 681
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Ionization, lipophilicity, and molecular modeling to investigate permeability and other biological properties of amlodipine

Giulia Caron, Giuseppe Ermondi, Alessandro Damiano, Laura Novaroli, Oksana Tsinman, Jeffrey A. Ruell and Alex Avdeef

Bioorganic & Medicinal Chemistry, 2004, 12, 6107
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The Lipophilicity Behavior of Three Catechol-O-methyltransferase (COMT) Inhibitors and Simple Analogues

Laura Novaroli, Geraldine Bouchard Doulakas, Marianne Reist, Barbara Rolando, Roberta Fruttero, Alberto Gasco and Pierre-Alain Carrupt

HCA, 2006, 89, 144
DOI: 10.1002/hlca.200690007

Fast log P determination by ultra-high-pressure liquid chromatography coupled with UV and mass spectrometry detections

Yveline Henchoz, Davy Guillarme, Sophie Martel, Serge Rudaz, Jean-Luc Veuthey and Pierre-Alain Carrupt

Anal Bioanal Chem, 2009, 394, 1919
DOI: 10.1007/s00216-009-2862-1

Solvation and hydration characteristics of ibuprofen and acetylsalicylic acid

German L. Perlovich, Sergey V. Kurkov, Andrey N. Kinchin and Annette Bauer-Brandl

AAPS J, 2004, 6, 22
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Microelectrochemical Techniques for Probing Kinetics at Liquid/Liquid Interfaces

Si-Xuan Guo, Patrick R. Unwin, Anna L. Whitworth and Jie Zhang

Progress in Reaction Kinetics and Mechanism, 2004, 29, 43
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Electrochemical Behavior of a Mitochondria-Targeted Antioxidant at an Interface between Two Immiscible Electrolyte Solutions: An Alternative Approach to Study Lipophilicity

José A. Ribeiro, Sofia Benfeito, Fernando Cagide, José Teixeira, Paulo J. Oliveira, Fernanda Borges, António F. Silva and Carlos M. Pereira

Anal. Chem., 2018, 90, 7989
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Indole‐based analogs of melatonin: in vitro antioxidant and cytoprotective activities

Marco Mor, Claudia Silva, Federica Vacondio, Pier Vincenzo Plazzi, Simona Bertoni, Gilberto Spadoni, Giuseppe Diamantini, Annalida Bedini, Giorgio Tarzia, Morena Zusso, Davide Franceschini and Pietro Giusti

Journal of Pineal Research, 2004, 36, 95
DOI: 10.1046/j.1600-079X.2003.00102.x

Thermosolvatochromism of Merocyanine Polarity Indicators in Pure and Aqueous Solvents: Relevance of Solvent Lipophilicity

Clarissa T. Martins, Michelle S. Lima and Omar A. El Seoud

J. Org. Chem., 2006, 71, 9068
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Drug permeation in biomembranes

Annika Mälkiä, Lasse Murtomäki, Arto Urtti and Kyösti Kontturi

European Journal of Pharmaceutical Sciences, 2004, 23, 13
DOI: 10.1016/j.ejps.2004.05.009

Enthalpy of solvation correlations for gaseous solutes dissolved in chloroform and 1,2-dichloroethane based on the Abraham model

Christina Mintz, Katherine Burton, William E. Acree and Michael H. Abraham

Fluid Phase Equilibria, 2007, 258, 191
DOI: 10.1016/j.fluid.2007.06.016

Limits of rapid log P determination methods for highly lipophilic and flexible compounds

Sophie Martel, Frédéric Begnaud, William Schuler, Fabrice Gillerat, Nils Oberhauser, Alessandra Nurisso and Pierre-Alain Carrupt

Analytica Chimica Acta, 2016, 915, 90
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Combined molecular lipophilicity descriptors and their role in understanding intramolecular effects

Giulia Caron, Frédéric Reymond, Pierre-Alain Carrupt, Hubert H. Girault and Bernard Testa

Pharmaceutical Science & Technology Today, 1999, 2, 327
DOI: 10.1016/S1461-5347(99)00180-7

Facilitated Transfer of Alkali Metal Ions by a Tetraester Derivative of Thiacalix[4]arene at the Liquid–Liquid Interface

Emine Guler Akgemci, Haluk Bingol, Mustafa Ersoz and Ivan Stibor

Electroanalysis, 2008, 20, 1354
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Measurement of the relative hydrophobicity of organic compounds without organic solvent. Effects of salt composition and pH on organic acids and nonionic compounds

Nellie Gulyaeva, Alexander Zaslavsky, Arnon Chait and Boris Zaslavsky

Journal of Pharmaceutical Sciences, 2001, 90, 1366
DOI: 10.1002/jps.1089

Lipophilicity Measurement by Reversed‐Phase High‐Performance Liquid Chromatography (RP‐HPLC): A Comparison of Two Stationary Phases Based on Retention Mechanisms

Xiangli Liu, Hideji Tanaka, Aiko Yamauchi, Bernard Testa and Hiroshi Chuman

Helvetica Chimica Acta, 2004, 87, 2866
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Hydrodynamic voltammetry at the liquid–liquid interface: Application to the transfer of ionised drug molecules

Matěj Velický, Kin Y. Tam and Robert A.W. Dryfe

Journal of Electroanalytical Chemistry, 2012, 683, 94
DOI: 10.1016/j.jelechem.2012.07.037

Improving the Oral Bioavailability of the Iron Chelator HBED by Breaking the Symmetry of the Intramolecular H-Bond Network

Bernard Faller, Carsten Spanka, Thomas Sergejew and Vincenzo Tschinke

J. Med. Chem., 2000, 43, 1467
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Evaluation and Prediction of Drug Permeation

Alessandra Pagliara, Marianne Reist, Sandrine Geinoz, Pierre-Alain Carrupt and Bernard Testa

Journal of Pharmacy and Pharmacology, 1999, 51, 1339
DOI: 10.1211/0022357991777164

Kinetics of facilitated proton transfer by hydrophobic aromatic amines across the water/1,2-dichloroethane interface

Miguel Velázquez-Manzanares and David J. Schiffrin

Electrochimica Acta, 2004, 49, 4651
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Electrochemistry at liquid/liquid interfaces: methodology and potential applications

Frédéric Reymond, David Fermı́n, Hye Jin Lee and Hubert H. Girault

Electrochimica Acta, 2000, 45, 2647
DOI: 10.1016/S0013-4686(00)00343-1

Imidazole H3-antagonists: relationship between structure and ex vivo binding to rat brain H3-receptors

Federica Vacondio, Marco Mor, Claudia Silva, Valentina Zuliani, Mirko Rivara, Silvia Rivara, Fabrizio Bordi, Pier Vincenzo Plazzi, Francesca Magnanini, Simona Bertoni, Vigilio Ballabeni, Elisabetta Barocelli, Pierre-Alain Carrupt and Bernard Testa

European Journal of Pharmaceutical Sciences, 2004, 23, 89
DOI: 10.1016/j.ejps.2004.06.003

Structural Properties Governing Retention Mechanisms on Immobilized Artificial Membrane (IAM) HPLC Columns

Agnes Taillardat-Bertschinger, Francesco Barbato, Maria Tiziana Quercia, Pierre-Alain Carrupt, Marianne Reist, Maria I. La Rotonda and Bernard Testa

HCA, 2002, 85, 519
DOI: 10.1002/1522-2675(200202)85:2<519::AID-HLCA519>3.0.CO;2-Q

In Silico and In Vitro Filters for the Fast Estimation of Skin Permeation and Distribution of New Chemical Entities

Giorgio Ottaviani, Sophie Martel and Pierre-Alain Carrupt

J. Med. Chem., 2007, 50, 742
DOI: 10.1021/jm0611105

Lipophilicity Measurement of Drugs by Reversed Phase HPLC over Wide pH Range Using an Alkaline-Resistant Silica-Based Stationary Phase, XBridgeTM Shield RP18

Xiangli Liu, Hossam Hefesha, Hideji Tanaka, Gerhard Scriba and Alfred Fahr

Chem. Pharm. Bull., 2008, 56, 1417
DOI: 10.1248/cpb.56.1417

Partitioning Behavior of Aromatic Components in Jet Fuel into Diverse Membrane-coated Fibers

Ronald E. Baynes, Xin-Rui Xia, Beth M. Barlow and Jim E. Riviere

Journal of Toxicology and Environmental Health, Part A, 2007, 70, 1879
DOI: 10.1080/15287390701549146

Time-Resolved Laser-Induced Fluorescence Study of Photoinduced Electron Transfer at the Water/1,2-Dichloroethane Interface

Robert A. W. Dryfe, Zhifeng Ding, R. Geoffrey Wellington, Pierre F. Brevet, Alexander M. Kuznetzov and Hubert H. Girault

J. Phys. Chem. A, 1997, 101, 2519
DOI: 10.1021/jp9630434

An electrochemical method for the determination of liposome–water partition coefficients of drugs

Marjukka Ikonen, Lasse Murtomäki and Kyösti Kontturi

Journal of Electroanalytical Chemistry, 2007, 602, 189
DOI: 10.1016/j.jelechem.2006.12.014

Effects of Charge and Intramolecular Structure on the Lipophilicity of Nitrophenols

Véronique Chopineaux-Courtois, Frédéric Reymond, Géraldine Bouchard, Pierre-Alain Carrupt, Bernard Testa and Hubert H. Girault

J. Am. Chem. Soc., 1999, 121, 1743
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Reformulating the Kinetic Approach of Column Chromatography for a Single Component

Alexander M. Kuznetsov and Hubert H. Giraultb

Helvetica Chimica Acta, 1997, 80, 1176
DOI: 10.1002/hlca.19970800415

Partition Coefficients of Ionizable Compounds ino-Nitrophenyl Octyl Ether/Water Measured by the Potentiometric Method

Xiangli Liu, Géraldine Bouchard, Hubert H. Girault, Bernard Testa and Pierre-Alain Carrupt

Anal. Chem., 2003, 75, 7036
DOI: 10.1021/ac034972b

Novel RPLC stationary phases for lipophilicity measurement: Solvatochromic analysis of retention mechanisms for neutral and basic compounds

Cinzia Stella, Alexandra Galland, Xiangli Liu, Bernard Testa, Serge Rudaz, Jean‐Luc Veuthey and Pierre‐Alain Carrupt

J of Separation Science, 2005, 28, 2350
DOI: 10.1002/jssc.200500104

Electrochemical determination of the lipophilicity scale of arenediazonium ions based on the ion transfer across the liquid ∣ liquid interface

Young-Tae Kong and Takashi Kakiuchi

Journal of Electroanalytical Chemistry, 2000, 483, 22
DOI: 10.1016/S0022-0728(00)00012-7

Theoretical and Experimental Exploration of the Lipophilicity of Zwitterionic Drugs in the 1,2-Dichloroethane/Water System

Géraldine Bouchard, Alessandra Pagliara, Pierre-Alain Carrupt, Bernard Testa, Véronique Gobry and Hubert H. Girault

Pharm Res, 2002, 19, 1150
DOI: 10.1023/A:1019846125723

Quantitative Structure-Permeation Relationships (QSPeRs) to Predict Skin Permeation: A Critical Evaluation

Sandrine Geinoz, Richard H. Guy, Bernard Testa and Pierre-Alain Carrupt

Pharm Res, 2004, 21, 83
DOI: 10.1023/B:PHAM.0000012155.27488.2b

Ion-transfer Voltammetry of Local Anesthetics at an Organic Solvent/Water Interface and Pharmacological Activity vs. Ion Partition Coefficient Relationship

Yuko Kubota, Hajime Katano and Mitsugi Senda

ANAL. SCI., 2001, 17, 65
DOI: 10.2116/analsci.17.65

Ionic partition diagrams of ionisable drugs: pH-lipophilicity profiles, transfer mechanisms and charge effects on solvation

Frédéric Reymond, Véronique Chopineaux-Courtois, Guillaume Steyaert, Géraldine Bouchard, Pierre-Alain Carrupt, Bernard Testa and Hubert H Girault

Journal of Electroanalytical Chemistry, 1999, 462, 235
DOI: 10.1016/S0022-0728(98)00418-5

Lipophilicity and Its Relationship with Passive Drug Permeation

Xiangli Liu, Bernard Testa and Alfred Fahr

Pharm Res, 2011, 28, 962
DOI: 10.1007/s11095-010-0303-7

The influence of lipophilicity on the pharmacokinetic behavior of drugs: Concepts and examples

Bernard Testa, Patrizia Crivori, Marianne Reist and Pierre-Alain Carrupt

Perspectives in Drug Discovery and Design, 2000, 19, 179
DOI: 10.1023/A:1008741731244

Electrochemical Investigation of Heavy Metal Ion Transfer Across the Water/1,2‐Dichloroethane Interface Assisted by 9‐Ethyl‐3‐Carbazolecarboxaldehyde‐Thiosemicarbazone

Haluk Bingol, Emine G. Akgemci, Mustafa Ersoz and Tevfik Atalay

Electroanalysis, 2007, 19, 1327
DOI: 10.1002/elan.200703843

An insight into the intensification of aqueous/organic phase reaction by the addition of magnetic polymer nanoparticles

Ren Jing, Jun Tang, Qi Zhang, Liang Chen, Dengxiang Ji, Fengwen Yu, Meizhen Lu, Jianbing Ji and Jianli Wang

Chemical Engineering Journal, 2015, 280, 265
DOI: 10.1016/j.cej.2015.05.088

The Apparent Lipophilicity of Quaternary Ammonium Ions Is Influenced by Galvani Potential Difference, Not Ion-Pairing: A Cyclic Voltammetry Study

Géraldine Bouchard, Pierre–Alain Carrupt, Bernard Testa, Véronique Gobry and Hubert H. Girault

Pharm Res, 2001, 18, 702
DOI: 10.1023/A:1011001914685

Polarized Potential Window Available at the Interface Between an Aqueous Electrolyte Solution and Tetraalkylammonium Imide Salts

Takashi KAKIUCHI, Norihiro TSUJIOKA, Kenji SUEISHI, Naoya NISHI and Masahiro YAMAMOTO

Electrochemistry, 2004, 72, 833
DOI: 10.5796/electrochemistry.72.833

Facilitated ion transfer reactions across oil|water interfaces

Frédéric Reymond, Gregoire Lagger, Pierre-Alain Carrupt and Hubert H. Girault

Journal of Electroanalytical Chemistry, 1998, 451, 59
DOI: 10.1016/S0022-0728(97)00428-2

Synthesis and electrochemical properties of a novel calix[4]arene derivative for facilitated transfer of alkali metal ions across water/1,2-dichloroethane micro-interface

Ferhat Kaykal, Haluk Bingol, Ahmet B. Sariguney, Ahmet Coskun and Emine G. Akgemci

Supramolecular Chemistry, 2011, 23, 570
DOI: 10.1080/10610278.2011.575466

Estimation of Molecular Linear Free Energy Relationship Descriptors by a Group Contribution Approach. 2. Prediction of Partition Coefficients

James A. Platts, Michael H. Abraham, Darko Butina and Anne Hersey

J. Chem. Inf. Comput. Sci., 2000, 40, 71
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An NMR Method for the Quantitative Assessment of Intramolecular Hydrogen Bonding; Application to Physicochemical, Environmental, and Biochemical Properties

Michael H. Abraham, Raymond J. Abraham, William E. Acree, Abil E. Aliev, Al J. Leo and William L. Whaley

J. Org. Chem., 2014, 79, 11075
DOI: 10.1021/jo502080p

Applications of Electrochemistry at the ITIES in Drug Discovery and Development – A Review

José A. Ribeiro and Carlos M. Pereira

ChemElectroChem, 2024, 11
DOI: 10.1002/celc.202400134

A New Salt Bridge Based on the Hydrophobic Room-Temperature Molten Salt

Takashi Kakiuchi and Takahiro Yoshimatsu

Bulletin of the Chemical Society of Japan, 2006, 79, 1017
DOI: 10.1246/bcsj.79.1017

Correlation and prediction of partition coefficients for solute transfer to 1,2-dichloroethane from both water and from the gas phase

Laura M. Sprunger, Jennifer Gibbs, William E. Acree and Michael H. Abraham

Fluid Phase Equilibria, 2008, 273, 78
DOI: 10.1016/j.fluid.2008.08.014