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. 2023 Nov 9;8(46):44250–44264. doi: 10.1021/acsomega.3c06936

Table 3. Results of the In Vitro DHFR Inhibition Assay and Docking Interaction Energy.

comp. no. IC50 (μM)a DHFR inhibition docking interaction energy (kcal/mol)
4 5.00 ± 0.23 –11.8926764
5a 4.20 ± 0.20 –13.0764761
5b 4.10 ± 0.19 –12.7614536
5c 4.00 ± 0.18 –13.6169386
6a 5.56 ± 0.27 –12.004714
6b 6.45 ± 0.31 –10.8985271
7 6.70 ± 0.31 –11.0561876
TMP 5.54 ± 0.28 –10.6276875
a

IC50 (μM): Expressed as mean ± SD.