(Z)-1-[5-(2-chloro-4-nitrophenyl)furan-2-yl]-N-morpholin-4-ylmethanimine

Formula:C15H14N3O4Cl Mutagenic:high Tumorigenic:high Reproductive Effective:high (Z)-1-[5-(2-chloro-4-nitrophenyl)furan-2-yl]-N-morpholin-4-ylmethanimine is a drug-like molecule.

MolName	(Z)-1-[5-(2-chloro-4-nitrophenyl)furan-2-yl]-N-morpholin-4-ylmethanimine
MolecularFormula	C15H14N3O4Cl
Smiles	[O-][N+](c(cc1)cc(Cl)c1-c1ccc(/C=N\N2CCOCC2)o1)=O
InChI	InChI=1S/C15H14ClN3O4/c16-14-9-11(19(20)21)1-3-13(14)15-4-2-12(23-15)10-17-18-5-7-22-8-6-18/h1-4,9-10H,5-8H2
InChIK	NUMYKHIBOLAYSJ-UHFFFAOYSA-N
TotalMolweight	335.746
Molweight	335.746
MonoisotopicMass	335.067284
CLogP	2.1148
CLogS	-4.487
H Acceptors	7
TotalSurfaceArea	248.4
Relative PSA	0.28015
PolarSurfaceArea	83.79
Druglikeness	0.24249
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	aromatic nitro; imine/hydrazone of aldehyde
Shape Index	0.65217
Fragments	1
Non HAtoms	23
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	7
Symmetricatoms	2
AcidicOxygens	1
StereoCon

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