(Z,E)-3-(2-nitrophenyl)-N-[(Z)-[(E)-3-(2-nitrophenyl)prop-2-enylidene]amino]prop-2-en-1-imine

Formula:C18H14N4O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z,E)-3-(2-nitrophenyl)-N-[(Z)-[(E)-3-(2-nitrophenyl)prop-2-enylidene]amino]prop-2-en-1-imine is a drug-like molecule.

MolName	(Z,E)-3-(2-nitrophenyl)-N-[(Z)-[(E)-3-(2-nitrophenyl)prop-2-enylidene]amino]prop-2-en-1-imine
MolecularFormula	C18H14N4O4
Smiles	[O-][N+](c1c(/C=C/C=N\N=C/C=C/c(cccc2)c2[N+]([O-])=O)cccc1)=O
InChI	InChI=1S/C18H14N4O4/c23-21(24)17-11-3-1-7-15(17)9-5-13-19-20-14-6-10-16-8-2-4-12-18(16)22(25)26/h1-14H
InChIK	PXADKZMQRKBQMZ-UHFFFAOYSA-N
TotalMolweight	350.333
Molweight	350.333
MonoisotopicMass	350.101506
CLogP	2.979
CLogS	-5.636
H Acceptors	8
TotalSurfaceArea	282.88
Relative PSA	0.29645
PolarSurfaceArea	116.36
Druglikeness	-3.7483
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro; dimethylene-hydrazine; imine/hydrazone of aldehyde
Shape Index	0.61538
Fragments	1
Non HAtoms	26
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	7
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	13
AcidicOxygens	2
StereoCon

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