New developments in hydrogen bonding acidity and basicity of small organic molecules for the prediction of physical and ADMET properties. part 2. the universal solvation equation

Journal of Chemical Information and Modeling

Volumn 49, Issue 3, 2009, Pages 634-646

  Oliferenko, Polina V ^a   Oliferenko, Alexander A ^a   Poda, Gennadiy ^b   Palyulin, Vladimir A ^a   Zeflrov, Nikolay S ^a   Katritzky, Alan R ^c  

^a MOSCOW STATE UNIVERSITY   (Russian Federation)

^b PFIZER GLOBAL RESEARCH AND DEVELOPMENT   (United States)

^c University of Florida   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ALKALINITY; FORECASTING; HYDROGEN; PHASE EQUILIBRIA; SOLVATION;

ACCURATE ESTIMATION; AQUEOUS SOLUBILITY; DESOLVATION ENERGY; FLUID-PHASE EQUILIBRIUM; INTERPHASE TRANSFER; MOLECULAR FRAGMENTS; PROTEIN-LIGAND DOCKING; SMALL ORGANIC MOLECULES;

HYDROGEN BONDS;

CATION; SOLVENT;

ARTICLE; CHEMISTRY; HYDROGEN BOND; PH;

CATIONS; HYDROGEN BONDING; HYDROGEN-ION CONCENTRATION; SOLVENTS;

EID: 65249118844     PISSN: 15499596     EISSN: 1549960X     Source Type: Journal    
DOI: 10.1021/ci800323q     Document Type: Article

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