(E)-3-(2-bromo-4-nitroanilino)-1-(4-bromophenyl)prop-2-en-1-one

Formula:C15H10N2O3Br2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(2-bromo-4-nitroanilino)-1-(4-bromophenyl)prop-2-en-1-one is a drug-like molecule.

MolName	(E)-3-(2-bromo-4-nitroanilino)-1-(4-bromophenyl)prop-2-en-1-one
MolecularFormula	C15H10N2O3Br2
Smiles	[O-][N+](c(cc1)cc(Br)c1N/C=C/C(c(cc1)ccc1Br)=O)=O
InChI	InChI=1S/C15H10Br2N2O3/c16-11-3-1-10(2-4-11)15(20)7-8-18-14-6-5-12(19(21)22)9-13(14)17/h1-9,18H
InChIK	FIKACGORPWFUKK-UHFFFAOYSA-N
TotalMolweight	426.063
Molweight	426.063
MonoisotopicMass	423.905815
CLogP	3.0033
CLogS	-5.914
H Acceptors	5
H Donors	1
TotalSurfaceArea	249.66
Relative PSA	0.21998
PolarSurfaceArea	74.92
Druglikeness	-6.3725
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.68182
Fragments	1
Non HAtoms	22
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	2
AcidicOxygens	1
StereoCon

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