(E)-3-(3-nitrophenyl)-N-[3-(2-oxochromen-3-yl)phenyl]prop-2-enamide

Formula:C24H16N2O5 Mutagenic:none Tumorigenic:none Reproductive Effective:high (E)-3-(3-nitrophenyl)-N-[3-(2-oxochromen-3-yl)phenyl]prop-2-enamide is a drug-like molecule.

MolName	(E)-3-(3-nitrophenyl)-N-[3-(2-oxochromen-3-yl)phenyl]prop-2-enamide
MolecularFormula	C24H16N2O5
Smiles	[O-][N+](c1cc(/C=C/C(Nc2cc(C3=Cc(cccc4)c4OC3=O)ccc2)=O)ccc1)=O
InChI	InChI=1S/C24H16N2O5/c27-23(12-11-16-5-3-9-20(13-16)26(29)30)25-19-8-4-7-17(14-19)21-15-18-6-1-2-10-22(18)31-24(21)28/h1-15H,(H,25,27)
InChIK	WZAXYWKVVLDOSK-UHFFFAOYSA-N
TotalMolweight	412.4
Molweight	412.4
MonoisotopicMass	412.105923
CLogP	3.3077
CLogS	-5.669
H Acceptors	7
H Donors	1
TotalSurfaceArea	311.12
Relative PSA	0.25058
PolarSurfaceArea	101.22
Druglikeness	-4.435
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.58065
Fragments	1
Non HAtoms	31
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	2
Amides	1
AcidicOxygens	1
StereoCon

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