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. 2022 Apr 8;9:857256. doi: 10.3389/fnut.2022.857256

Table 5.

In silico prediction studies of carvacrol from SwissADME and Iazar.

Chem I.D. 10,364
Molecular formula C10H14O
Molecular weight 150.22
X Log P3 3.49
Log S −3.31
Hydrogen bond donor 1
Hydrogen bond acceptor 1
Rotatable bond count 1
Topological polar surface area 20.23 A2
GI absorption High
Log Kp (skin permeation) −4.74 cm/s
Lipinski rule Yes; 0 violation
Carcinogenicity (Rat) None
Mutagenicity (Salmonella typhimurium) Non-mutagenic