Title of article
Synthesis, modelling and NK1 antagonist evaluation of a non-rigid cyclopropane-containing analogue of CP-99,994
Author/Authors
David J. Aitken، نويسنده , , Sandrine Ongeri، نويسنده , , Danielle Vallée-Goyet، نويسنده , , Jean-Claude Gramain، نويسنده , , Henri-Philippe Husson، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 2001
Pages
3
From page
659
To page
661
Abstract
A non-rigid cyclopropane-containing diamine analogue of CP-99,994 was synthesised and was found to have only moderate NK1 receptor binding affinity. Molecular dynamics calculations of the conformational space of the former compound gave good correlation between observed activity and a recently published pharmacophore model, lending predictive value to the latter.
Journal title
Bioorganic & Medicinal Chemistry Letters
Serial Year
2001
Journal title
Bioorganic & Medicinal Chemistry Letters
Record number
791246
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