2-(2-bromo-4-nitrophenoxy)-N-[(Z)-[5-(4-iodophenyl)furan-2-yl]methylideneamino]acetamide

Formula:C19H13N3O5BrI Mutagenic:high Tumorigenic:high Reproductive Effective:low 2-(2-bromo-4-nitrophenoxy)-N-[(Z)-[5-(4-iodophenyl)furan-2-yl]methylideneamino]acetamide is not a drug-like molecule.

MolName	2-(2-bromo-4-nitrophenoxy)-N-[(Z)-[5-(4-iodophenyl)furan-2-yl]methylideneamino]acetamide
MolecularFormula	C19H13N3O5BrI
Smiles	[O-][N+](c(cc1)cc(Br)c1OCC(N/N=C\c1ccc(-c(cc2)ccc2I)o1)=O)=O
InChI	InChI=1S/C19H13BrIN3O5/c20-16-9-14(24(26)27)5-7-18(16)28-11-19(25)23-22-10-15-6-8-17(29-15)12-1-3-13(21)4-2-12/h1-10H,11H2,(H,23,25)
InChIK	OUFPBFMHYYZVEF-UHFFFAOYSA-N
TotalMolweight	570.132
Molweight	570.132
MonoisotopicMass	568.908331
CLogP	3.9561
CLogS	-7.271
H Acceptors	8
H Donors	1
TotalSurfaceArea	328.78
Relative PSA	0.27538
PolarSurfaceArea	109.65
Druglikeness	-0.058735
Mutagenic	high
Tumorigenic	high
Reproductive Effective	low
Irritant	none
Nasty Functions	aromatic nitro; acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.68966
Fragments	1
Non HAtoms	29
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	3
Symmetricatoms	2
AcidicOxygens	1
StereoCon

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1 - 2-(2-bromo-4-nitrophenoxy)-N-[(Z)-[5-(4-iodophenyl)furan-2-yl]methylideneamino]acetamide | 2 - 2-(2-bromo-4-nitrophenoxy)-N-[(Z)-[5-(4-iodophenyl)furan-2-yl]methylideneamino]acetamide

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