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

Formula:C15H10N2O3Br2 Mutagenic:high Tumorigenic:low Reproductive Effective:none (Z)-2-bromo-N-(2-bromo-4-nitrophenyl)-3-phenylprop-2-enamide is a drug-like molecule.

MolName	(Z)-2-bromo-N-(2-bromo-4-nitrophenyl)-3-phenylprop-2-enamide
MolecularFormula	C15H10N2O3Br2
Smiles	[O-][N+](c(cc1)cc(Br)c1NC(/C(/Br)=C/c1ccccc1)=O)=O
InChI	InChI=1S/C15H10Br2N2O3/c16-12-9-11(19(21)22)6-7-14(12)18-15(20)13(17)8-10-4-2-1-3-5-10/h1-9H,(H,18,20)
InChIK	DBJNUWLTGHEOGT-UHFFFAOYSA-N
TotalMolweight	426.063
Molweight	426.063
MonoisotopicMass	423.905815
CLogP	3.5325
CLogS	-5.625
H Acceptors	5
H Donors	1
TotalSurfaceArea	247.87
Relative PSA	0.22157
PolarSurfaceArea	74.92
Druglikeness	-11.753
Mutagenic	high
Tumorigenic	low
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro; 2-halo-enone
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
Symmetricatoms	2
Amides	1
AcidicOxygens	1
StereoCon

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