scholarly journals A QSPR approach to the ecotoxicity of ionic liquids (Vibrio fischeri) using VolSurf principal properties

2016 ◽  
Vol 5 (4) ◽  
pp. 1090-1096 ◽  
Author(s):  
Alessio Paterno’ ◽  
Salvatore Scire ◽  
Giuseppe Musumarra
Keyword(s):  
Ionic Liquids ◽  
In Silico ◽  
Vibrio Fischeri ◽  
Structural Descriptors ◽  
Parameter Equation

In silico structural descriptors for both cation and anion counterparts of ILs allow the prediction of Vibrio fischeri toxicity by means of a simple three parameter equation.

Thermophysical properties and acute toxicity towards green algae and Vibrio fischeri of amino acid-based ionic liquids

2015 ◽  
Vol 212 ◽  
pp. 352-359 ◽  
Author(s):  
Ouahid Ben Ghanem ◽  
Nicolas Papaiconomou ◽  
M.I. Abdul Mutalib ◽  
Sylvie Viboud ◽  
Mohanad El-Harbawi ◽  
...  
Keyword(s):  
Ionic Liquids ◽  
Amino Acid ◽  
Acute Toxicity ◽  
Green Algae ◽  
Thermophysical Properties ◽  
Vibrio Fischeri

Polarity study of ionic liquids with the solvatochromic dye Nile Red: a QSPR approach using in silico VolSurf+ descriptors

Tetrahedron ◽  
2016 ◽  
Vol 72 (23) ◽  
pp. 3282-3287 ◽  
Author(s):  
Alessio Paterno' ◽  
Francesca D'Anna ◽  
Cosimo G. Fortuna ◽  
Giuseppe Musumarra
Keyword(s):  
Ionic Liquids ◽  
In Silico ◽  
Nile Red ◽  
Solvatochromic Dye

Acute Toxicity of Oxygenated and Non-Oxygenated Imidazolium-Based Ionic Liquids to Daphnia magna and Vibrio fischeri

2007 ◽  
Vol preprint (2007) ◽  
pp. 1
Author(s):  
Chiara Samorì ◽  
Andrea Pasteris ◽  
Paola Galletti ◽  
Emilio Tagliavini
Keyword(s):  
Ionic Liquids ◽  
Acute Toxicity ◽  
Daphnia Magna ◽  
Vibrio Fischeri

Correlating the structure and composition of ionic liquids with their toxicity on Vibrio fischeri: A systematic study

2012 ◽  
Vol 215-216 ◽  
pp. 40-48 ◽  
Author(s):  
Sylvie Viboud ◽  
Nicolas Papaiconomou ◽  
Aurélien Cortesi ◽  
Grégory Chatel ◽  
Micheline Draye ◽  
...  
Keyword(s):  
Ionic Liquids ◽  
Systematic Study ◽  
Vibrio Fischeri

scholarly journals Design, Sustainable Synthesis, Characterization, Antimicrobial Evaluation and in silico ADMET Prediction of New Functionalized Imidazolium Based Ionic Liquids

2020 ◽  
Vol 32 (8) ◽  
pp. 1972-1980
Author(s):  
Anas R. Al Johani ◽  
Saud M. Almutairi ◽  
Wael S. El-Sayed ◽  
Pramod K. Sahu ◽  
Praveen K. Sahu ◽  
...  
Keyword(s):  
Ionic Liquids ◽  
In Silico ◽  
Phenyl Group ◽  
Antimicrobial Activities ◽  
Spectral Techniques ◽  
In Silico Admet ◽  
Antimicrobial Evaluation ◽  
Ft Ir

A series of sixteen new ionic liquids (ILs) bearing imidazolium moiety were designed and synthesized under sustainable and green conditions which were confirmed by analytical and spectral techniques using 1H- & 13C-NMR, FT-IR, mass and elemental analysis. A panel of clinically isolated strains was used for in vitro inhibitory antimicrobial activities screening of synthesized ionic liquids. The results of antimicrobial assay showed that some of synthesized ionic liquids showed moderate to good activity. Among these ILs, ionic liquids 3, 4 and 5 (bearing alkyl chain with a phenyl group) significantly inhibited cell growth of strains. In this regard, these ionic liquids considered as promising antibacterial agents when compared with standard antibiotics. By encouraging in vitro antimicrobial screening, in silico ADMET evaluation has been performed and found excellent pharmacokinetic, bioavailability and toxicity profiles. Synthesized ionic liquids has found to be safe and non-toxic according to calculated in vivo computed LD50 values (2.49-2.80 mg/kg) for rat acute toxicity.

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