Estimation of pKa Using Semiempirical Molecular Orbital Methods. Part 2: Application to Amines, Anilines and Various Nitrogen Containing Heterocyclic Compounds.

BG Tehan, EJ Lloyd, MG Wong, WR Pitt… - Quantitative …, 2002 - Wiley Online Library
The pKa of a compound directly influences its biopharmaceutical profile. This article
describes the development of a method for estimating pKa values for a number of nitrogen …
被引用次数：104 相关文章

[引用][C] Estimation of pKa using semiempirical molecular orbital methods. Part 2: application to amines, anilines and various nitrogen containing heterocyclic …

BG Tehan, EJ Lloyd, MG Wong, WR Pitt… - Quantitative …, 2002 - research.monash.edu
Estimation of pKa using semiempirical molecular orbital methods. Part 2: application to amines,
anilines and various nitrogen containing heterocyclic compounds — Monash University Skip to …

[引用][C] Estimation of pKa Using Semiempirical Molecular Orbital Methods. Part 2: Application to Amines, Anilines and Various Nitrogen Containing Heterocyclic …

BG Tehan, EJ Lloyd, MG Wong, WR Pitt… - Quantitative Structure …, 2002 - cir.nii.ac.jp
Estimation of pKa Using Semiempirical Molecular Orbital Methods. Part 2: Application to
Amines, Anilines and Various Nitrogen Containing Heterocyclic Compounds. | CiNii …