Figure 2 | Scientific Reports

Figure 2

From: Investigation of the antimycobacterial activity of African medicinal plants combined with chemometric analysis to identify potential leads

Figure 2

2D chemical representations of tentative compounds from C. asiaticum predicted to be active against M. smegmatis and M. aurum. (1) dihydronarcissidine, (2) 3,4-dimethoxyhydrocinnamic acid, (3) ambellin, (4) acetylcaranine, (5) 6-(2-(5-hydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-yloxy)acetamido)hexanoic acid, (6) 3,4-dihydroxyphenylglycol, (7) 3',4'-dimethoxy-2-hydroxyacetophenone, and (8) (E)-8,11,12-trihydroxyoctadec-9-enoic acid. Mr molecular mass, cLogP consensus LogP, TPSA total polar surface area and #RB number of rotatable bonds. TPSA, cLogP and #RB were computed using the online SwissADME application44.

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