(E)-3-(4-chloro-3-nitrophenyl)-N-[3-chloro-4-(2-oxochromen-3-yl)phenyl]prop-2-enamide

Formula:C24H14N2O5Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:high (E)-3-(4-chloro-3-nitrophenyl)-N-[3-chloro-4-(2-oxochromen-3-yl)phenyl]prop-2-enamide is a drug-like molecule.

MolName	(E)-3-(4-chloro-3-nitrophenyl)-N-[3-chloro-4-(2-oxochromen-3-yl)phenyl]prop-2-enamide
MolecularFormula	C24H14N2O5Cl2
Smiles	[O-][N+](c(cc(/C=C/C(Nc(cc1)cc(Cl)c1C1=Cc(cccc2)c2OC1=O)=O)cc1)c1Cl)=O
InChI	InChI=1S/C24H14Cl2N2O5/c25-19-9-5-14(11-21(19)28(31)32)6-10-23(29)27-16-7-8-17(20(26)13-16)18-12-15-3-1-2-4-22(15)33-24(18)30/h1-13H,(H,27,29)
InChIK	GUJDOFJNLBEXFH-UHFFFAOYSA-N
TotalMolweight	481.29
Molweight	481.29
MonoisotopicMass	480.027977
CLogP	4.5197
CLogS	-7.141
H Acceptors	7
H Donors	1
TotalSurfaceArea	341.96
Relative PSA	0.22798
PolarSurfaceArea	101.22
Druglikeness	-4.3483
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	aromatic nitro
Shape Index	0.57576
Fragments	1
Non HAtoms	33
NonCHAtoms	9
Electronegative Atoms	9
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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