(E)-N-(5-chloro-2-morpholin-4-ylphenyl)-3-(3-nitrophenyl)prop-2-enamide

Formula:C19H18N3O4Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-N-(5-chloro-2-morpholin-4-ylphenyl)-3-(3-nitrophenyl)prop-2-enamide is a drug-like molecule.

MolName	(E)-N-(5-chloro-2-morpholin-4-ylphenyl)-3-(3-nitrophenyl)prop-2-enamide
MolecularFormula	C19H18N3O4Cl
Smiles	[O-][N+](c1cccc(/C=C/C(Nc(cc(cc2)Cl)c2N2CCOCC2)=O)c1)=O
InChI	InChI=1S/C19H18ClN3O4/c20-15-5-6-18(22-8-10-27-11-9-22)17(13-15)21-19(24)7-4-14-2-1-3-16(12-14)23(25)26/h1-7,12-13H,8-11H2,(H,21,24)
InChIK	NJYVGYWVOLULDA-UHFFFAOYSA-N
TotalMolweight	387.822
Molweight	387.822
MonoisotopicMass	387.098584
CLogP	2.4897
CLogS	-4.797
H Acceptors	7
H Donors	1
TotalSurfaceArea	289.66
Relative PSA	0.23638
PolarSurfaceArea	87.39
Druglikeness	-4
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.55556
Fragments	1
Non HAtoms	27
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	7
Symmetricatoms	2
Amides	1
Amines	1
Aromatic Amines	1
AcidicOxygens	1
StereoCon

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