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

Formula:C19H14N2O3ClF5 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-1-[2-[(2-chloropyridin-3-yl)oxymethyl]morpholin-4-yl]-3-(2,3,4,5,6-pentafluorophenyl)prop-2-en-1-one is a drug-like molecule.

MolName	(E)-1-[2-[(2-chloropyridin-3-yl)oxymethyl]morpholin-4-yl]-3-(2,3,4,5,6-pentafluorophenyl)prop-2-en-1-one
MolecularFormula	C19H14N2O3ClF5
Smiles	O=C(/C=C/c(c(F)c(c(F)c1F)F)c1F)N1CC(COc2cccnc2Cl)OCC1
InChI	InChI=1S/C19H14ClF5N2O3/c20-19-12(2-1-5-26-19)30-9-10-8-27(6-7-29-10)13(28)4-3-11-14(21)16(23)18(25)17(24)15(11)22/h1-5,10H,6-9H2/t10-/m1/s1
InChIK	UBGYOCAVGSBKJX-SNVBAGLBSA-N
TotalMolweight	448.774
Molweight	448.774
MonoisotopicMass	448.06131
CLogP	3.213
CLogS	-4.298
H Acceptors	5
TotalSurfaceArea	307.54
Relative PSA	0.15465
PolarSurfaceArea	51.66
Druglikeness	1.7202
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	polyhalo aromatic ring
Shape Index	0.56667
Fragments	1
Non HAtoms	30
NonCHAtoms	11
Electronegative Atoms	11
StereoCenters	1
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	7
Symmetricatoms	4
Amides	1
Aromatic Nitrogens	1
StereoCon	racemate

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

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