N,N'-bis[(Z)-(3-nitrophenyl)methylideneamino]hexanediamide

Formula:C20H20N6O6 Mutagenic:none Tumorigenic:none Reproductive Effective:none N,N'-bis[(Z)-(3-nitrophenyl)methylideneamino]hexanediamide is not a drug-like molecule.

MolName	N,N'-bis[(Z)-(3-nitrophenyl)methylideneamino]hexanediamide
MolecularFormula	C20H20N6O6
Smiles	[O-][N+](c1cccc(/C=N\NC(CCCCC(N/N=C\c2cccc([N+]([O-])=O)c2)=O)=O)c1)=O
InChI	InChI=1S/C20H20N6O6/c27-19(23-21-13-15-5-3-7-17(11-15)25(29)30)9-1-2-10-20(28)24-22-14-16-6-4-8-18(12-16)26(31)32/h3-8,11-14H,1-2,9-10H2,(H,23,27)(H,24,28)
InChIK	OIGXARFYWZPPQG-UHFFFAOYSA-N
TotalMolweight	440.415
Molweight	440.415
MonoisotopicMass	440.144434
CLogP	2.5128
CLogS	-6.118
H Acceptors	12
H Donors	2
TotalSurfaceArea	343.34
Relative PSA	0.38696
PolarSurfaceArea	174.56
Druglikeness	-9.2744
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro; acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.6875
Fragments	1
Non HAtoms	32
NonCHAtoms	12
Electronegative Atoms	12
Rotatable Bond	11
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	6
Symmetricatoms	16
AcidicOxygens	2
StereoCon

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