Catalysts are substances that increase the reaction rate of a chemical reaction without being consumed in the process. 38487-86-4, Name is 2-Amino-4-chlorobenzonitrile, SMILES is NC1=CC(Cl)=CC=C1C#N, belongs to nitriles-buliding-blocks compound. In a document, author is Jilkova, Adela, introduce the new discover, Formula: C7H5ClN2.
Azanitrile Inhibitors of the SmCB1 Protease Target Are Lethal to Schistosoma mansoni: Structural and Mechanistic Insights into Chemotype Reactivity
Azapeptide nitrites are postulated to reversibly covalently react with the active-site cysteine residue of cysteine proteases and form isothiosemicarbazide adducts. We investigated the interaction of azadipeptide nitrites with the cathepsin B1 drug target (SmCB1) from Schistosoma mansoni, a pathogen that causes the global neglected disease schistosomiasis. Azadipeptide ranitr nitriles were superior inhibitors of SmCB1 over their parent carba analogs. We determined the crystal structure of SmCB1 in complex with an azadipeptide nitrite and analyzed the reaction mechanism using quantum chemical calculations. The data demonstrate that azadipeptide nitrites, in contrast to their carba counterparts, undergo a change from E- to Z-configuration upon binding, which gives rise to a highly favorable energy profile of noncovalent and covalent complex formation. Finally, azadipeptide nitrites were considerably more lethal than their carba analogs against the schistosome pathogen in culture, supporting the further development of this chemotype as a treatment for schistosomiasis.
The proportionality constant is the rate constant for the particular unimolecular reaction. the reaction rate is directly proportional to the concentration of the reactant. I hope my blog about 38487-86-4 is helpful to your research. Formula: C7H5ClN2.