(Z)-1-(4-chlorophenyl)-N-(2,4-dinitrophenoxy)-2-morpholin-4-ylethanimine

Formula:C18H17N4O6Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-1-(4-chlorophenyl)-N-(2,4-dinitrophenoxy)-2-morpholin-4-ylethanimine is a drug-like molecule.

MolName	(Z)-1-(4-chlorophenyl)-N-(2,4-dinitrophenoxy)-2-morpholin-4-ylethanimine
MolecularFormula	C18H17N4O6Cl
Smiles	[O-][N+](c(cc1)cc([N+]([O-])=O)c1O/N=C(\CN1CCOCC1)/c(cc1)ccc1Cl)=O
InChI	InChI=1S/C18H17ClN4O6/c19-14-3-1-13(2-4-14)16(12-21-7-9-28-10-8-21)20-29-18-6-5-15(22(24)25)11-17(18)23(26)27/h1-6,11H,7-10,12H2
InChIK	LVZNYQYDCHCSRI-UHFFFAOYSA-N
TotalMolweight	420.808
Molweight	420.808
MonoisotopicMass	420.083663
CLogP	0.7334
CLogS	-5.591
H Acceptors	10
TotalSurfaceArea	304.35
Relative PSA	0.3151
PolarSurfaceArea	125.7
Druglikeness	-1.9131
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.48276
Fragments	1
Non HAtoms	29
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	10
Symmetricatoms	4
Amines	1
AlkylAmines	1
BasicNitrogens	1
AcidicOxygens	2
StereoCon

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