(E)-3-(2,3,4,5,6-pentafluorophenyl)-1-[2-[[5-(trifluoromethyl)pyridin-2-yl]oxymethyl]morpholin-4-yl]prop-2-en-1-one

Formula:C20H14N2O3F8 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(2,3,4,5,6-pentafluorophenyl)-1-[2-[[5-(trifluoromethyl)pyridin-2-yl]oxymethyl]morpholin-4-yl]prop-2-en-1-one is a drug-like molecule.

MolName	(E)-3-(2,3,4,5,6-pentafluorophenyl)-1-[2-[[5-(trifluoromethyl)pyridin-2-yl]oxymethyl]morpholin-4-yl]prop-2-en-1-one
MolecularFormula	C20H14N2O3F8
Smiles	O=C(/C=C/c(c(F)c(c(F)c1F)F)c1F)N1CC(COc2ncc(C(F)(F)F)cc2)OCC1
InChI	InChI=1S/C20H14F8N2O3/c21-15-12(16(22)18(24)19(25)17(15)23)2-4-14(31)30-5-6-32-11(8-30)9-33-13-3-1-10(7-29-13)20(26,27)28/h1-4,7,11H,5-6,8-9H2/t11-/m1/s1
InChIK	CLOZJQFCHDQYBG-LLVKDONJSA-N
TotalMolweight	482.326
Molweight	482.326
MonoisotopicMass	482.087667
CLogP	3.7093
CLogS	-5.102
H Acceptors	5
TotalSurfaceArea	321.58
Relative PSA	0.14789
PolarSurfaceArea	51.66
Druglikeness	-4.1817
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	polyhalo aromatic ring
Shape Index	0.57576
Fragments	1
Non HAtoms	33
NonCHAtoms	13
Electronegative Atoms	13
StereoCenters	1
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	8
Symmetricatoms	6
Amides	1
Aromatic Nitrogens	1
StereoCon	racemate

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1 - (E)-3-(2,3,4,5,6-pentafluorophenyl)-1-[2-[[5-(trifluoromethyl)pyridin-2-yl]oxymethyl]morpholin-4-yl]prop-2-en-1-one | 2 - (E)-3-(2,3,4,5,6-pentafluorophenyl)-1-[2-[[5-(trifluoromethyl)pyridin-2-yl]oxymethyl]morpholin-4-yl]prop-2-en-1-one

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