Concepedia

Investigation of biological activity of 2,3-disubstituted quinazolin-4(1<i>H</i>)-ones against <i>Mycobacterium tuberculosis</i> and DNA <i>via</i> docking, spectroscopy and DFT studies

C.B. Pradeep Kumar, M.S. Raghu, K. N. N. Prasad, S. Chandrasekhar, B.K. Jayanna, Fahad A. Alharthi, M.K. Prashanth, K. Yogesh Kumar

New Journal of Chemistry · 2020 · 44 citations · 44 references

DOI

Concepts

Abstract

Docking studies, structural data of DNA binding and molecular dynamics simulations of substituted quinazolin-4(1<italic>H</italic>)-ones.

References

44

UCSF Chimera—A visualization system for exploratory research and analysis

Eric F. Pettersen, Thomas D. Goddard, Conrad C. Huang et al. · Journal of Computational Chemistry · 2004 · 47.8K citations

, , +17

SwissADME: a free web tool to evaluate pharmacokinetics, drug-likeness and medicinal chemistry friendliness of small molecules

Antoine Daina, Olivier Michielin, Vincent Zoete · Scientific Reports · 2017 · 17.1K citations · Full text

, , +16

Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings

Christopher A. Lipinski, Franco Lombardo, Beryl W. Dominy et al. · Advanced Drug Delivery Reviews · 2012 · 3.7K citations

, , +16

A BOILED‐Egg To Predict Gastrointestinal Absorption and Brain Penetration of Small Molecules

Antoine Daina, Vincent Zoete · ChemMedChem · 2016 · 2.4K citations · Full text

, , +17

Voltammetric studies of the interaction of metal chelates with DNA. 2. Tris-chelated complexes of cobalt(III) and iron(II) with 1,10-phenanthroline and 2,2'-bipyridine

Michael T. Carter, Marisol Rodriguez, Allen J. Bard · Journal of the American Chemical Society · 1989 · 1.6K citations

, , +14