Table 4 ADMET parameters for chamanetin.

Formula

C₁₆H₂₆O₅

Molecular weight

308.45 g/mol

Num. heavy atoms

21

Fraction Csp3

1.0

Num. rotatable bonds

0

Num. H-bond acceptors

5

Num. H-bond donors

4

Molar Refractivity

76.34

TPSA (topological polar surface area)

90.15 Ų

Water solubility log S (ESOL)

− 1.60

GI absorption

High

Skin permeation (Log K_p)

− 8.35 cm/s

Bioavailability score

0.55

Synthetic accessibility

5.37