Literature DB >> 857018

Quantitative structure--activity relationships. 7. The bilinear model, a new model for nonlinear dependence of biological activity on hydrophobic character.

H Kubinyi.   

Abstract

The bilinear model, log 1/C =a log P-b log (betaP+1) +C, a new model for nonlinear dependence of biological activity on hydrophobic character, is applied to 57 data sets of biological activity values in homologous series. From a comparison of the statistical parameters and the residuals obtained with the bilinear model and the parabolic model, the superiority of the bilinear model for a precise quantitative description of both linear and nonlinear parts of sturcture-activity relationships can be derived; the bilinear model explains the particular effect that in homologous series the relationship between biological activity and hydrophobic character is strictly linear for the lower members, while for higher members this relationship is nonlinear.

Mesh:

Year:  1977        PMID: 857018     DOI: 10.1021/jm00215a002

Source DB:  PubMed          Journal:  J Med Chem        ISSN: 0022-2623            Impact factor:   7.446


  17 in total

Review 1.  Quantitative structure-activity relationships (QSAR) and molecular modelling in cancer research.

Authors:  H Kubinyi
Journal:  J Cancer Res Clin Oncol       Date:  1990       Impact factor: 4.553

Review 2.  Modeling kinetics of subcellular disposition of chemicals.

Authors:  Stefan Balaz
Journal:  Chem Rev       Date:  2009-05       Impact factor: 60.622

3.  QSAR modeling: where have you been? Where are you going to?

Authors:  Artem Cherkasov; Eugene N Muratov; Denis Fourches; Alexandre Varnek; Igor I Baskin; Mark Cronin; John Dearden; Paola Gramatica; Yvonne C Martin; Roberto Todeschini; Viviana Consonni; Victor E Kuz'min; Richard Cramer; Romualdo Benigni; Chihae Yang; James Rathman; Lothar Terfloth; Johann Gasteiger; Ann Richard; Alexander Tropsha
Journal:  J Med Chem       Date:  2014-01-06       Impact factor: 7.446

4.  In memoriam professor Corwin Hansch: birth pangs of QSAR before 1961.

Authors:  Toshio Fujita
Journal:  J Comput Aided Mol Des       Date:  2011-06-22       Impact factor: 3.686

5.  Quantile regression model for a diverse set of chemicals: application to acute toxicity for green algae.

Authors:  Jonathan Villain; Sylvain Lozano; Marie-Pierre Halm-Lemeille; Gilles Durrieu; Ronan Bureau
Journal:  J Mol Model       Date:  2014-11-29       Impact factor: 1.810

6.  A systematic investigation of quaternary ammonium ions as asymmetric phase-transfer catalysts. Application of quantitative structure activity/selectivity relationships.

Authors:  Scott E Denmark; Nathan D Gould; Larry M Wolf
Journal:  J Org Chem       Date:  2011-05-06       Impact factor: 4.354

Review 7.  Does transbilayer diffusion have a role in membrane transport of drugs?

Authors:  Stefan Balaz
Journal:  Drug Discov Today       Date:  2012-06-15       Impact factor: 7.851

8.  Nonlinear dependence in comparative molecular field analysis.

Authors:  K H Kim
Journal:  J Comput Aided Mol Des       Date:  1993-02       Impact factor: 3.686

9.  QSPR Modeling of Bioconcentration Factors of Nonionic Organic Compounds.

Authors:  Omar Deeb; Padmakar V Khadikar; Mohammad Goodarzi
Journal:  Environ Health Insights       Date:  2010-07-06

10.  H2-antihistaminics. 20. Structure-activity relationships in H2-receptor antagonists containing a 4-pyrimidone moiety.

Authors:  J P Spengler; K Wegner; W Schunack
Journal:  Agents Actions       Date:  1984-04
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