Chai, Xiaoyun published the artcileSynthesis and biological evaluation of triazole derivatives as potential antifungal agent, Computed Properties of 86386-77-8, the publication is Chemical Biology & Drug Design (2012), 80(3), 382-387, database is CAplus and MEDLINE.
A series of triazole antifungal agents with piperidine side chains was designed and synthesized. Results of preliminary antifungal tests against eight human pathogenic fungi in vitro showed that all the title compounds exhibited excellent activities with broad spectrum. Moreover, a mol. model for the binding between compound I and the active site of CACYP51 was provided based on the computational docking results. The side chain of the compound I is oriented into substrate access channel 2 (FG loop) and forms hydrophobic and van der waals interactions with surrounding hydrophobic residues. The Ph group of the side chain can interact with the Ph group of Phe380 through the formation of π-π face-to-edge interaction.
Chemical Biology & Drug Design published new progress about 86386-77-8. 86386-77-8 belongs to triazoles, auxiliary class Epoxides,Triazole,Fluoride,Salt,Sulfonic acid,Benzene, name is 1-((2-(2,4-Difluorophenyl)oxiran-2-yl)methyl)-1H-1,2,4-triazole methanesulfonate, and the molecular formula is C12H13F2N3O4S, Computed Properties of 86386-77-8.
Referemce:
https://en.wikipedia.org/wiki/1,2,3-Triazole,
Triazoles – an overview | ScienceDirect Topics