(3E)-3-amino-N-cyclohexyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxyimino]propanamide

Formula:C18H24N4O6 Mutagenic:none Tumorigenic:none Reproductive Effective:none (3E)-3-amino-N-cyclohexyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxyimino]propanamide is a drug-like molecule.

MolName	(3E)-3-amino-N-cyclohexyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxyimino]propanamide
MolecularFormula	C18H24N4O6
Smiles	N/C(/CC(NC1CCCCC1)=O)=N/OCc1cc([N+]([O-])=O)cc2c1OCOC2
InChI	InChI=1S/C18H24N4O6/c19-16(8-17(23)20-14-4-2-1-3-5-14)21-28-10-13-7-15(22(24)25)6-12-9-26-11-27-18(12)13/h6-7,14H,1-5,8-11H2,(H2,19,21)(H,20,23)
InChIK	HVPSTZYTHCMXJC-UHFFFAOYSA-N
TotalMolweight	392.411
Molweight	392.411
MonoisotopicMass	392.169586
CLogP	0.8067
CLogS	-4.713
H Acceptors	10
H Donors	2
TotalSurfaceArea	296.97
Relative PSA	0.37613
PolarSurfaceArea	140.99
Druglikeness	-6.5645
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.57143
Fragments	1
Non HAtoms	28
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	14
Symmetricatoms	2
Amides	1
AcidicOxygens	1
StereoCon

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