4-[(Z)-[[2-(2,4-dichlorophenoxy)acetyl]hydrazinylidene]methyl]-2-nitrophenolate

Formula:C15H10N3O5Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:high 4-[(Z)-[[2-(2,4-dichlorophenoxy)acetyl]hydrazinylidene]methyl]-2-nitrophenolate is a drug-like molecule.

MolName	4-[(Z)-[[2-(2,4-dichlorophenoxy)acetyl]hydrazinylidene]methyl]-2-nitrophenolate
MolecularFormula	C15H10N3O5Cl2
Smiles	[O-]c(ccc(/C=N\NC(COc(ccc(Cl)c1)c1Cl)=O)c1)c1[N+]([O-])=O
InChI	InChI=1S/C15H11Cl2N3O5/c16-10-2-4-14(11(17)6-10)25-8-15(22)19-18-7-9-1-3-13(21)12(5-9)20(23)24/h1-7,21H,8H2,(H,19,22)/p-1
InChIK	LWPHQWMHYOBRIU-UHFFFAOYSA-M
TotalMolweight	383.166
Molweight	383.166
MonoisotopicMass	381.999751
CLogP	1.1432
CLogS	-5.137
H Acceptors	8
H Donors	1
TotalSurfaceArea	272.79
Relative PSA	0.33253
PolarSurfaceArea	119.57
Druglikeness	-0.88795
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	aromatic nitro; acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.64
Fragments	1
Non HAtoms	25
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
AcidicOxygens	1
StereoCon

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