(E)-N-(2-bromo-4-nitrophenyl)-3-(2-chlorophenyl)prop-2-enamide

Formula:C15H10N2O3BrCl Mutagenic:none Tumorigenic:high Reproductive Effective:none (E)-N-(2-bromo-4-nitrophenyl)-3-(2-chlorophenyl)prop-2-enamide is a drug-like molecule.

MolName	(E)-N-(2-bromo-4-nitrophenyl)-3-(2-chlorophenyl)prop-2-enamide
MolecularFormula	C15H10N2O3BrCl
Smiles	[O-][N+](c(cc1)cc(Br)c1NC(/C=C/c(cccc1)c1Cl)=O)=O
InChI	InChI=1S/C15H10BrClN2O3/c16-12-9-11(19(21)22)6-7-14(12)18-15(20)8-5-10-3-1-2-4-13(10)17/h1-9H,(H,18,20)
InChIK	ZNDURDFWQHRJKR-UHFFFAOYSA-N
TotalMolweight	381.612
Molweight	381.612
MonoisotopicMass	379.956331
CLogP	3.5459
CLogS	-5.528
H Acceptors	5
H Donors	1
TotalSurfaceArea	246.45
Relative PSA	0.22284
PolarSurfaceArea	74.92
Druglikeness	-7.2409
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.63636
Fragments	1
Non HAtoms	22
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Amides	1
AcidicOxygens	1
StereoCon

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