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. 2020 Feb 4;7:920. doi: 10.3389/fchem.2019.00920

Table 3.

Four best R428 analogs according to the GOLD and MOE molecular docking scores.

Compound PubChem CID 2D structure Score (GOLD) Score, kcal/mol (MOE)
R428_1 67104315 graphic file with name fchem-07-00920-i0001.jpg 88.1 −8.6
R428_2 67104254 graphic file with name fchem-07-00920-i0002.jpg 83.6 −8.5
R428_3 67103757 graphic file with name fchem-07-00920-i0003.jpg 84.1 −8.5
R428_4 67103760 graphic file with name fchem-07-00920-i0004.jpg 82.6 −8.6