2-[(2,4-dichlorophenyl)methoxy]-1,5-diiodo-3-[(E)-2-nitroethenyl]benzene

Formula:C15H9NO3Cl2I2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(2,4-dichlorophenyl)methoxy]-1,5-diiodo-3-[(E)-2-nitroethenyl]benzene is not a drug-like molecule.

MolName	2-[(2,4-dichlorophenyl)methoxy]-1,5-diiodo-3-[(E)-2-nitroethenyl]benzene
MolecularFormula	C15H9NO3Cl2I2
Smiles	[O-][N+](/C=C/c1cc(I)cc(I)c1OCc(ccc(Cl)c1)c1Cl)=O
InChI	InChI=1S/C15H9Cl2I2NO3/c16-11-2-1-10(13(17)6-11)8-23-15-9(3-4-20(21)22)5-12(18)7-14(15)19/h1-7H,8H2
InChIK	QDQWVQYMOTWIEY-UHFFFAOYSA-N
TotalMolweight	575.946
Molweight	575.946
MonoisotopicMass	574.804894
CLogP	4.2041
CLogS	-7.471
H Acceptors	4
TotalSurfaceArea	290.35
Relative PSA	0.13921
PolarSurfaceArea	55.05
Druglikeness	-6.0895
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.56522
Fragments	1
Non HAtoms	23
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
AcidicOxygens	1
StereoCon

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