(E)-3-(5-nitrofuran-2-yl)-N-[(Z)-(5-nitrofuran-2-yl)methylideneamino]prop-2-enamide

Formula:C12H8N4O7 Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-3-(5-nitrofuran-2-yl)-N-[(Z)-(5-nitrofuran-2-yl)methylideneamino]prop-2-enamide is not a drug-like molecule.

MolName	(E)-3-(5-nitrofuran-2-yl)-N-[(Z)-(5-nitrofuran-2-yl)methylideneamino]prop-2-enamide
MolecularFormula	C12H8N4O7
Smiles	[O-][N+](c1ccc(/C=C/C(N/N=C\c2ccc([N+]([O-])=O)o2)=O)o1)=O
InChI	InChI=1S/C12H8N4O7/c17-10(4-1-8-2-5-11(22-8)15(18)19)14-13-7-9-3-6-12(23-9)16(20)21/h1-7H,(H,14,17)
InChIK	IUTJYHSRMXYBAA-UHFFFAOYSA-N
TotalMolweight	320.217
Molweight	320.217
MonoisotopicMass	320.039301
CLogP	0.7678
CLogS	-5.425
H Acceptors	11
H Donors	1
TotalSurfaceArea	240.21
Relative PSA	0.52067
PolarSurfaceArea	159.38
Druglikeness	1.7488
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro; acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.69565
Fragments	1
Non HAtoms	23
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	10
Sp3Atoms	2
AcidicOxygens	2
StereoCon

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