Tipo
Artigos em Revista
Tipo de Documento
Artigo Completo
Título
Hydrogen bonding part 46: a review of the correlation and prediction of transport properties by an lfer method: physicochemical properties, brain penetration and skin permeability
Participantes na publicação
Michael H Abraham (Author)
Harpreet S Chadha (Author)
Filomena Martins (Author)
Dep. Química e Bioquímica
Robert C Mitchell (Author)
Michael W Bradbury (Author)
Julie A Gratton (Author)
Resumo
A number of solute descriptors that relate to the ability of a solute to take part in solute–solvent interactions have been identified, quantified and incorporated into a multiple linear regression equation. This general solvation equation can then be used for the correlation and prediction of solute effects in transport processes, that is, processes in which the main step is either the equilibrium transfer, or the rate of transfer, of a solute from one phase to another. Examples discussed include the solubility of gases and vapours in water, various water?solvent partitions, blood?brain distribution, brain perfusion, and skin permeability.
Data de Submissão/Pedido
1998-01-19
Data de Aceitação
1998-06-29
Data de Publicação
1999-03-26
Instituição
FACULDADE DE CIÊNCIAS DA UNIVERSIDADE DE LISBOA
Suporte
Pesticide Science
Identificadores da Publicação
ISSN - 0031-613X
Editora
Wiley
Coleção
Based on a paper presented at the meeting ‘Uptake of Agrochemicals and Pharmaceuticals’, organised by AH Cobb, AM Stalker and DJ Livingstone on behalf of the Pesticides Group and the Physicochemical and Biophysical Panel of the SCI and the Strathclyde Institute for Drug Research and held on 9 December 1997 at 14/15 Belgrave Square, London
Número de Páginas
11
Página Inicial
78
Página Final
88
Identificadores do Documento
DOI -
https://doi.org/10.1002/(sici)1096-9063(199901)55:1<78::aid-ps853>3.0.co;2-7
URL -
http://dx.doi.org/10.1002/(sici)1096-9063(199901)55:1<78::aid-ps853>3.0.co;2-7
Keywords
LFER
QSAR
Brain penetration
Skin permeation
Solvation
Hydrogen bonding