(E)-N-(2-chloropyridin-3-yl)-3-(4-nitrophenyl)prop-2-enamide

Formula:C14H10N3O3Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-N-(2-chloropyridin-3-yl)-3-(4-nitrophenyl)prop-2-enamide is a drug-like molecule.

MolName	(E)-N-(2-chloropyridin-3-yl)-3-(4-nitrophenyl)prop-2-enamide
MolecularFormula	C14H10N3O3Cl
Smiles	[O-][N+](c1ccc(/C=C/C(Nc2cccnc2Cl)=O)cc1)=O
InChI	InChI=1S/C14H10ClN3O3/c15-14-12(2-1-9-16-14)17-13(19)8-5-10-3-6-11(7-4-10)18(20)21/h1-9H,(H,17,19)
InChIK	SUYVFQIGKXLPSY-UHFFFAOYSA-N
TotalMolweight	303.704
Molweight	303.704
MonoisotopicMass	303.041069
CLogP	1.9172
CLogS	-3.662
H Acceptors	6
H Donors	1
TotalSurfaceArea	226.58
Relative PSA	0.2908
PolarSurfaceArea	87.81
Druglikeness	-5.4509
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.66667
Fragments	1
Non HAtoms	21
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	1
AcidicOxygens	1
StereoCon

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