(Z)-1-(4-nitrophenyl)-N-[4-[(Z)-(4-nitrophenyl)methylideneamino]piperazin-1-yl]methanimine

Formula:C18H18N6O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-1-(4-nitrophenyl)-N-[4-[(Z)-(4-nitrophenyl)methylideneamino]piperazin-1-yl]methanimine is a drug-like molecule.

MolName	(Z)-1-(4-nitrophenyl)-N-[4-[(Z)-(4-nitrophenyl)methylideneamino]piperazin-1-yl]methanimine
MolecularFormula	C18H18N6O4
Smiles	[O-][N+](c1ccc(/C=N\N(CC2)CCN2/N=C\c(cc2)ccc2[N+]([O-])=O)cc1)=O
InChI	InChI=1S/C18H18N6O4/c25-23(26)17-5-1-15(2-6-17)13-19-21-9-11-22(12-10-21)20-14-16-3-7-18(8-4-16)24(27)28/h1-8,13-14H,9-12H2
InChIK	SSNZYPMBMYCENQ-UHFFFAOYSA-N
TotalMolweight	382.379
Molweight	382.379
MonoisotopicMass	382.138954
CLogP	1.4158
CLogS	-4.21
H Acceptors	10
TotalSurfaceArea	292.02
Relative PSA	0.31149
PolarSurfaceArea	122.84
Druglikeness	0.025521
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro; imine/hydrazone of aldehyde
Shape Index	0.71429
Fragments	1
Non HAtoms	28
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	8
Symmetricatoms	17
AcidicOxygens	2
StereoCon

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