Table 2.
Entry name | Human oral absorption a | QPlogPo/w b | CNS c | mol MW d | donorHB e | accptHB f | Rule of five g |
---|---|---|---|---|---|---|---|
(4Z, 12Z)- Cyclopentadeca-4, 12-dienone | 80 | 4.393 | −2 | 220 | 2 | 4 | 0 |
a% Human oral absorption: <25% is poor absorption. bQPlogPo/w: Partition coefficient; recommended range -2.0 - 6.5. cCNS: Predictive Central Nervous Activity -2 (inactive) to +2 (active). dM.wt.: Molecular weight of the molecule < 500 is preferred. edonor HB: Estimated number of hydrogen bonds that would be donated by the solute to water molecules in an aqueous solution, recommended range 0.0 - 6.0 faccpt HB: Estimated number of hydrogen bonds that would be accepted by the solute from water molecules in an aqueous solution, recommended range 2 - 20. gRule of five: Number of violations of Lipinski’s rule of five; recommended range 0 - 4.