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Figure 4 | Journal of Cheminformatics

Figure 4

From: Quantitative estimation of pesticide-likeness for agrochemical discovery

Figure 4

Comparative representation of desirability functions. Desirability function curves describing the three classes of pesticides: herbicides, insecticides and fungicides, in terms of MW (molecular weight), LogP (log of the octanol–water partition coefficient), HBA (number hydrogen bond acceptors), HBD (number hydrogen bond donors), RB (rotatable bonds), and arR (number of aromatic rings); dark grey –overlapping area described by the three curves; light grey – maximum area described by the three curves.

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