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. 2022 Aug 17;2022:3290790. doi: 10.1155/2022/3290790

Table 6.

ADMET profile of selected three phytochemicals calculated by Osiris molecular property explorer.

Chemical descriptors Phthalic acid, isobutyl octadecyl ester Hexadecanoic acid,1(hydroxymethyl)1,2-ethanediylester 2,Myristynoyl pantetheine
Irritant Toxic effects No effects No effects
Mutagenic Toxic effects No effects No effects
Tumorigenic Toxic effects No effects No effects
Reproductive properties Toxic effects No effects No effects
cLogP 10.24 12.25 3.95
Solubility −725 −8.22 −5.4
MW 474.0 568.0 484.0
TPSA 52.6 72.83 141.0
Drug-likeness −30.1 −26.0 −43.1
Drug score 0.20 0.08 0.24