Skip to main content
. 2021 Nov 25;12:764351. doi: 10.3389/fphar.2021.764351

TABLE 6.

Newly designed PGAM1 inhibitors and the corresponding predicted activity value.

Number R1 R2 R3 R4 R5 R6 X CoMFA CoMSIA
79 graphic file with name fphar-12-764351-fx80.jpg OH H H H OH -C=O 7.07 7.03
80 graphic file with name fphar-12-764351-fx81.jpg OH H H H NH2 -C=O 7.05 6.99
81 graphic file with name fphar-12-764351-fx82.jpg OH H H H H -C=O 7.16 6.83
82 graphic file with name fphar-12-764351-fx83.jpg OH H H H H -C=O 7.14 7.07
83 graphic file with name fphar-12-764351-fx84.jpg OH H H H H -C=O 7.10 7.03
84 graphic file with name fphar-12-764351-fx85.jpg OH H H H OH -C=O 7.14 6.85
85 graphic file with name fphar-12-764351-fx85.jpg OH H H H OH -C=O 7.13 7.00