Search Result "logp calculation programs"


A New Group Contribution Approach to the Calculation of LogP

Journal: Current Computer-Aided Drug Design
Volume: 1 Issue: 1 Year: 2005 Page: 3-9
Author(s): Hao Zhu, Aleksander Sedykh, Suman K. Chakravarti, Gilles Klopman

Reliability of logP Predictions Based on Calculated Molecular Descriptors: A Critical Review

Journal: Current Medicinal Chemistry
Volume: 9 Issue: 2 Year: 2002 Page: 1819-1829
Author(s): D. Eros, I. Kovesdi, L. Orfi, K. Takacs-Novak, Gy. Acsady, Gy. Keri

The Impact of IKr Blockade on Medicinal Chemistry Programs

Journal: Current Topics in Medicinal Chemistry
Volume: 8 Issue: 1 Year: 2008 Page: 1128-1139
Author(s): Ian M. Bell, Mark T. Bilodeau

The Impact of Lipophilicity in Drug Research: A Case Report on ß-Blockers

Journal: Mini-Reviews in Medicinal Chemistry
Volume: 5 Issue: 2 Year: 2005 Page: 197-205
Author(s): Raimund Mannhold

Simultaneous Determination of LogD, LogP, and pKa of Drugs by Using a Reverse Phase HPLC Coupled with a 96-Well Plate Auto Injector

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 12 Issue: 3 Year: 2009 Page: 250-257
Author(s): Po-Chang Chiang, Yiding Hu

A Perspective on Quantum Mechanics Calculations in ADMET Predictions

Journal: Current Topics in Medicinal Chemistry
Volume: 13 Issue: 11 Year: 2013 Page: 1257-1272
Author(s): J. Phillip Bowen,Osman F. Guner

Artificial Membrane Assays to Assess Permeability

Journal: Current Drug Metabolism
Volume: 9 Issue: 9 Year: 2008 Page: 886-892
Author(s): Bernard Faller

Comparative Characterization of Experimental and Calculated Lipophilicity and Anti-Tumour Activity of Isochromanone Derivatives

Journal: Current Medicinal Chemistry
Volume: 17 Issue: 4 Year: 2010 Page: 321-333
Author(s): M. Huszar, A. Varga, A. Horvath, T. Lorand, A. Agocs, M. Idei, J. Mandl, T. Vantus, G. Keri

Calculating the Protonation States of Proteins and Small Molecules: Implications to Ligand-Receptor Interactions

Journal: Current Computer-Aided Drug Design
Volume: 4 Issue: 3 Year: 2008 Page: 169-179
Author(s): Rooplekha Mitra, Radhey Shyam, Indranil Mitra, Maria A. Miteva, Emil Alexov

Analysis of Pyridinium Aldoximes - A Chromatographic Approach

Journal: Current Medicinal Chemistry
Volume: 15 Issue: 2 Year: 2008 Page: 2401-2418
Author(s): T. Csermely, H. Kalasz, G. A. Petroianu, K. Kuca, F. Darvas, K. Ludanyi, A. A. Mudhafar, K. Tekes

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