Srivastava, Ruby published the artcileChemical reactivity theory (CRT) study of small drug-like biologically active molecules, Application of Thieno[2,3-b]pyrazin-7-amine, the publication is Journal of Biomolecular Structure and Dynamics (2021), 39(3), 943-952, database is CAplus and MEDLINE.
New biochem. screening and design based technol. are used to identify the small mols. in targeting RNA. These approaches has develop potential drug like small mol. for RNA-targeted therapeutics. Chem. Reactivity Theory (CRT) is used to study these drug-like, biol. active small mols. that target RNA. Twenty two small mols. based on structure (), information (), fragment (), small mol. microarrays (), and use of phenotypic assays () are selected for the studies of several DFT-based global reactivity and local reactivity descriptors to provide complete explanation for the reactivity of these complexes by chem. reactivity method. Higher HOMO-LUMO gap indicated the structural stability for the studied complexes. The complexes reflect greater thermodn. stability. Further the results predicted that high aromaticity and hardness are measures of high stability and low reactivity for the studied complexes. It was observed that a good, more reactive, nucleophile can be described by a lower value of μ, ω while a good electrophile can be described by a high value of μ, ω. TDDFT results predicted that few complexes can be used as fluorescent biomarkers as their emission wavelength lies in the visible region.
Journal of Biomolecular Structure and Dynamics published new progress about 59944-75-1. 59944-75-1 belongs to pyrazines, auxiliary class Other Aromatic Heterocyclic,Amine, name is Thieno[2,3-b]pyrazin-7-amine, and the molecular formula is C11H14O2, Application of Thieno[2,3-b]pyrazin-7-amine.
Referemce:
https://en.wikipedia.org/wiki/Pyrazine,
Pyrazine | C4H4N2 – PubChem