(E)-3-(2-chloro-6-fluorophenyl)-1-morpholin-4-ylprop-2-en-1-one

Formula:C13H13NO2ClF Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(2-chloro-6-fluorophenyl)-1-morpholin-4-ylprop-2-en-1-one is a drug-like molecule.

MolName	(E)-3-(2-chloro-6-fluorophenyl)-1-morpholin-4-ylprop-2-en-1-one
MolecularFormula	C13H13NO2ClF
Smiles	O=C(/C=C/c(c(F)ccc1)c1Cl)N1CCOCC1
InChI	InChI=1S/C13H13ClFNO2/c14-11-2-1-3-12(15)10(11)4-5-13(17)16-6-8-18-9-7-16/h1-5H,6-9H2
InChIK	ZBPBCLAPYNVEDD-UHFFFAOYSA-N
TotalMolweight	269.702
Molweight	269.702
MonoisotopicMass	269.061884
CLogP	2.3699
CLogS	-2.746
H Acceptors	3
TotalSurfaceArea	201.12
Relative PSA	0.13221
PolarSurfaceArea	29.54
Druglikeness	0.30181
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.61111
Fragments	1
Non HAtoms	18
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	2
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	5
Symmetricatoms	2
Amides	1
StereoCon

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