2-(2-bromo-4-chlorophenoxy)-N-[(Z)-(5-iodofuran-2-yl)methylideneamino]acetamide

Formula:C13H9N2O3BrClI Mutagenic:high Tumorigenic:high Reproductive Effective:high 2-(2-bromo-4-chlorophenoxy)-N-[(Z)-(5-iodofuran-2-yl)methylideneamino]acetamide is a drug-like molecule.

MolName	2-(2-bromo-4-chlorophenoxy)-N-[(Z)-(5-iodofuran-2-yl)methylideneamino]acetamide
MolecularFormula	C13H9N2O3BrClI
Smiles	O=C(COc(ccc(Cl)c1)c1Br)N/N=C\c(o1)ccc1I
InChI	InChI=1S/C13H9BrClIN2O3/c14-10-5-8(15)1-3-11(10)20-7-13(19)18-17-6-9-2-4-12(16)21-9/h1-6H,7H2,(H,18,19)
InChIK	KSDOXJPAWCEWEI-UHFFFAOYSA-N
TotalMolweight	483.482
Molweight	483.482
MonoisotopicMass	481.852979
CLogP	3.8309
CLogS	-5.532
H Acceptors	5
H Donors	1
TotalSurfaceArea	260.77
Relative PSA	0.23055
PolarSurfaceArea	63.83
Druglikeness	5.0287
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.71429
Fragments	1
Non HAtoms	21
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	2
StereoCon

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