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. Author manuscript; available in PMC: 2010 Mar 12.
Published in final edited form as: J Med Chem. 2009 Mar 12;52(5):1329–1344. doi: 10.1021/jm801374t

Figure 2.

Figure 2

3D-QSAR model for antitubercular nitroimidazoles. Compound 31 is shown aligned to a pharmacophore hypothesis featuring two hydrogen bond acceptors (green), one hydrogen bond donor (purple) and one hydrophobe (aqua). The predictive ability of this model for the 21 molecules in the training set and the 22 molecules in the test set is shown with the actual activity (MIC in µM) on the x-axis compared with the predicted activity on the y-axis.