N,N'-bis[(Z)-[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylideneamino]oxamide

Formula:C24H14N6O8Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:none N,N'-bis[(Z)-[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylideneamino]oxamide is not a drug-like molecule.

MolName	N,N'-bis[(Z)-[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylideneamino]oxamide
MolecularFormula	C24H14N6O8Cl2
Smiles	[O-][N+](c(cc1)cc(Cl)c1-c1ccc(/C=N\NC(C(N/N=C\c2ccc(-c(ccc([N+]([O-])=O)c3)c3Cl)o2)=O)=O)o1)=O
InChI	InChI=1S/C24H14Cl2N6O8/c25-19-9-13(31(35)36)1-5-17(19)21-7-3-15(39-21)11-27-29-23(33)24(34)30-28-12-16-4-8-22(40-16)18-6-2-14(32(37)38)10-20(18)26/h1-12H,(H,29,33)(H,30,34)
InChIK	JKHDUGSBQTUVPF-UHFFFAOYSA-N
TotalMolweight	585.315
Molweight	585.315
MonoisotopicMass	584.025018
CLogP	3.785
CLogS	-9.43
H Acceptors	14
H Donors	2
TotalSurfaceArea	418.04
Relative PSA	0.38532
PolarSurfaceArea	200.84
Druglikeness	0.21539
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro; acyl-hydrazone; imine/hydrazone of aldehyde; limit! oxal-diamide
Shape Index	0.65
Fragments	1
Non HAtoms	40
NonCHAtoms	16
Electronegative Atoms	16
Rotatable Bond	9
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	2
Symmetricatoms	20
AcidicOxygens	2
StereoCon

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