(Z)-2-chloro-N-(4-nitrophenyl)-3-phenylprop-2-enamide

Formula:C15H11N2O3Cl Mutagenic:high Tumorigenic:none Reproductive Effective:none (Z)-2-chloro-N-(4-nitrophenyl)-3-phenylprop-2-enamide is a drug-like molecule.

MolName	(Z)-2-chloro-N-(4-nitrophenyl)-3-phenylprop-2-enamide
MolecularFormula	C15H11N2O3Cl
Smiles	[O-][N+](c(cc1)ccc1NC(/C(/Cl)=C/c1ccccc1)=O)=O
InChI	InChI=1S/C15H11ClN2O3/c16-14(10-11-4-2-1-3-5-11)15(19)17-12-6-8-13(9-7-12)18(20)21/h1-10H,(H,17,19)
InChIK	HSIWVNOQMKINFV-UHFFFAOYSA-N
TotalMolweight	302.716
Molweight	302.716
MonoisotopicMass	302.04582
CLogP	2.6763
CLogS	-4.649
H Acceptors	5
H Donors	1
TotalSurfaceArea	226.03
Relative PSA	0.24298
PolarSurfaceArea	74.92
Druglikeness	-4.6847
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro; 2-halo-enone
Shape Index	0.66667
Fragments	1
Non HAtoms	21
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	4
Amides	1
AcidicOxygens	1
StereoCon

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