Biswal, R. Abhishek et al. published their research in Research Journal of Chemistry and Environment in 2020 | CAS: 2253-73-8

Isopropylisothiocyanate (cas: 2253-73-8) belongs to esters. Esters are also usually derived from carboxylic acids. It may also be obtained by reaction of acid anhydride or acid halides with alcohols or by the reaction of salts of carboxylic acids with alkyl halides. Esterification is the general name for a chemical reaction in which two reactants (typically an alcohol and an acid) form an ester as the reaction product. Esters are common in organic chemistry and biological materials.Application of 2253-73-8

In silico and ADMET evaluation of bioactive drug compounds of Turbinaria ornata against fungal enzyme Candidapepsin (Secreted Aspartic Protease) was written by Biswal, R. Abhishek;Pazhamalai, Vivek. And the article was included in Research Journal of Chemistry and Environment in 2020.Application of 2253-73-8 The following contents are mentioned in the article:

The mol. docking anal. of bioactive compounds of Turbinaria ornata against the fungal disease candida pepsin was done. This study mainly reveals the inhibition potential of each drug mol. against targeted enzyme by interacting with the amino acids. The targeted enzymes were studies and retrieved from PDB by removing heteroatoms and water mols. The organic bioactive compounds were screened by using Lipinski rule of five and ADMET properties for knowing drug likeliness. The mol. docking anal. was done against virulent protein by using Autodock software 4.2.6. The visualization of docked confirmation was visualized by using Discovery studio 3.1. The organic bioactive compound namely Benzo(k)fluoranthene, Tetramethrin-1 and Kresoxim Me have better inhibition potential with binding energy -6.44 Kcal/mol, -5.91 Kcal/mol and -5.51 Kcal/mol resp. This study mainly focuses on computational perspectives of structure based protein ligand docking for the development of novel drug therapy. This study involved multiple reactions and reactants, such as Isopropylisothiocyanate (cas: 2253-73-8Application of 2253-73-8).

Isopropylisothiocyanate (cas: 2253-73-8) belongs to esters. Esters are also usually derived from carboxylic acids. It may also be obtained by reaction of acid anhydride or acid halides with alcohols or by the reaction of salts of carboxylic acids with alkyl halides. Esterification is the general name for a chemical reaction in which two reactants (typically an alcohol and an acid) form an ester as the reaction product. Esters are common in organic chemistry and biological materials.Application of 2253-73-8

Referemce:
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics