. 2023 Aug 31;66(18):12739–12750. doi: 10.1021/acs.jmedchem.3c00689

Table 1. Illustration of SPS Partial Scores for Every Atomic Index in the Depicted Small Molecule^a.

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The total SPS calculated for the compound is 364, and the nSPS is equal to 26.0. Abbreviations: i, atom index; h, hybridization term; s, stereoisomeric term; r, non-aromatic ring term; n, heavy-atom neighbors.

Table 1. Illustration of SPS Partial Scores for Every Atomic Index in the Depicted Small Moleculea.

Table 1. Illustration of SPS Partial Scores for Every Atomic Index in the Depicted Small Molecule^a.