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. Author manuscript; available in PMC: 2021 Apr 1.
Published in final edited form as: J Comput Aided Mol Des. 2019 Dec 19;34(4):405–420. doi: 10.1007/s10822-019-00271-3

Figure 3. Molecules included in the SAMPL6 Part II log P Challenge set.

Figure 3.

Reliable experimental potentiometric log P measurements were collected for the 11 molecules depicted here. Reported uncertainties are expressed as the standard error of the mean (SEM) of replicate measurements. Molecules are depicted using OpenEye OEDepict Tool [61]. Canonical isomeric SMILES strings of all compounds are given in Table 1, and replicate log P measurements can be found in Table S2.