Tiwari, Gargi; Sharma, Dipendra; Singh, N. B. published the artcile< Electronic structure and molecular docking studies of an anti-HIV drug: stavudine>, HPLC of Formula: 112-63-0, the main research area is stavudine anti HIV electronic structure mol docking.
For anti HIV activity, Stavudine (or D4T or Zerit) is an important nucleoside reverse transcriptase inhibitor (NRTI). Mol. geometry of this compound has been optimized by DFT B3LYP/6-31G (d,p) method using Gaussian 03 software package. In order to examine global reactivity descriptors of the drug mol., Frontier orbital anal. has been carried out. Using mol. docking inhibition activity of the drug against HIV-1 reverse transcriptase (6AN2) has been investigated. Attempts have been made to elucidate the chem. and biol. properties of the drug.
Journal of Scientific & Industrial Research published new progress about Anti-HIV agents. 112-63-0 belongs to class esters-buliding-blocks, and the molecular formula is C19H34O2, HPLC of Formula: 112-63-0.
Referemce:
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics