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Lipinkski's Rule

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Phytochemical		Molecular Formula		Mw		HBD		HBA		LogP		PSA		Scientific Name		Source
Miquelianin		C21H18O13		478.36		8		13		-0.172		0.534		Foeniculum vulgare		Foeniculum vulgare_general
Cyanidin 3-O-glucoside		C21H21O11+		449.385		8		10		1.108		0.47		Bauhinia variegata		General
Astragalin		C21H20O11		448.377		7		11		-0.058		0.463		Bauhinia variegata		General
5,7,4'-Trihydroxyflavanone 4'-O-rutinoside		C27H32O14		580.535		8		14		-0.415		0.425		Bauhinia variegata		General
Tricetin 7,3',4',5'-trimethyl eter 5-xylosyl-(1->2)-rhamnoside		C30H36O15		636.598		5		15		0.551		0.327		Bauhinia variegata		General
(2S)-5,7-Dimethoxy-3',4'-methylenedioxyflavanone		C18H16O6		328.316		0		6		2.835		0.201		Bauhinia variegata		Root
Naringenin 5,7-dimethylether 4'-O-[alpha-L-rhamnopyranosyl(1->4)-beta-D-glucopyranoside]		C29H36O14		608.588		6		14		0.036		0.351		Bauhinia variegata		Stem
Gibberellin A1		C19H24O6		348.39		3		6		0.617		0.319		Carica papaya		Carica papaya_general
Gibberellin A3		C19H22O6		346.374		3		6		0.442		0.325		Carica papaya		Carica papaya_general
Glucobrassicin		C16H20N2O9S2		351.358		5		9		-0.951		0.407		Lepidium sativum		Lepidium sativum_general
Myristic acid		C14H28O2		228.371		1		2		5.48		0.13		Hyoscyamus niger		Hyoscyamus niger_general
Octadecanoic acid		C18H36O2		228.371		1		2		5.48		0.13		Hyoscyamus niger		Hyoscyamus niger_general
alpha-Pinene		C10H16		136.234		0		0		2.872		0		Valeriana jatamansi		Valeriana jatamansi_Root oil
4-Isopropyl benzaldehyde		C10H12O		136.234		0		0		3.502		0		Cuminum cyminum		Cuminum cyminum_General
p-Cymene		C10H14		148.202		0		1		2.783		0.097		Valeriana jatamansi		Valeriana jatamansi_Root oil
p-Cymene		C10H14		134.218		0		0		3.51		0		Valeriana jatamansi		Valeriana jatamansi_Root oil
(R)-linalool		C10H18O		154.249		1		1		2.735		0.094		Cuminum cyminum		Cuminum cyminum_Fruits and Seed
alpha-Terpinene		C10H16		136.234		0		0		3.448		0		Cuminum cyminum		Cuminum cyminum_Fruits and Seed
alpha-Terpinene		C10H16		136.234		0		0		3.448		0		Foeniculum vulgare		Foeniculum vulgare_general
gamma-Terpinene		C10H16		136.234		0		0		3.448		0		Cuminum cyminum		Cuminum cyminum_Fruits and Seed

Total rows: 282

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