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. 2020 Apr 30;63(18):10170–10187. doi: 10.1021/acs.jmedchem.0c00415

Table 3. Properties of Oral EMsa.

  oral organic EMs (n = 217)
  all, n (n = 217) de novo, n (n = 108) nature-inspired, n (n = 80) natural, n (n = 29)
MW ≤ 500 Da 179 87 69 24
clogP ≤ 5 189 95 70 24
HBAs ≤ 10 188 96 68 24
HBDs ≤ 5 208 107 75 26
0 or 1 violations 186 94 67 25
2 or more violations 31 14 13 4
a

Abbreviations: clogP, calculated logP; HBA, hydrogen bond acceptor; HBD, hydrogen bond donor; MW, molecular weight; clogP were extracted using DrugBank21 or ChemSpider42 databases.