(E)-N-(4-chlorophenyl)-2-cyano-3-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]prop-2-enamide

Formula:C22H20N3O4Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-N-(4-chlorophenyl)-2-cyano-3-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]prop-2-enamide is a drug-like molecule.

MolName	(E)-N-(4-chlorophenyl)-2-cyano-3-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]prop-2-enamide
MolecularFormula	C22H20N3O4Cl
Smiles	N#C/C(/C(Nc(cc1)ccc1Cl)=O)=C\c(cc1)ccc1OCC(N1CCOCC1)=O
InChI	InChI=1S/C22H20ClN3O4/c23-18-3-5-19(6-4-18)25-22(28)17(14-24)13-16-1-7-20(8-2-16)30-15-21(27)26-9-11-29-12-10-26/h1-8,13H,9-12,15H2,(H,25,28)
InChIK	OYGSDCGIYAFRGQ-UHFFFAOYSA-N
TotalMolweight	425.871
Molweight	425.871
MonoisotopicMass	425.114234
CLogP	2.8435
CLogS	-3.996
H Acceptors	7
H Donors	1
TotalSurfaceArea	327.42
Relative PSA	0.22799
PolarSurfaceArea	91.66
Druglikeness	0.41665
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.66667
Fragments	1
Non HAtoms	30
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	7
Symmetricatoms	6
Amides	2
StereoCon

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