[2-[2-(4-nitrobenzoyl)hydrazinyl]-2-oxoethyl] 2-oxo-1H-quinoline-4-carboxylate

Formula:C19H14N4O7 Mutagenic:none Tumorigenic:none Reproductive Effective:none [2-[2-(4-nitrobenzoyl)hydrazinyl]-2-oxoethyl] 2-oxo-1H-quinoline-4-carboxylate is not a drug-like molecule.

MolName	[2-[2-(4-nitrobenzoyl)hydrazinyl]-2-oxoethyl] 2-oxo-1H-quinoline-4-carboxylate
MolecularFormula	C19H14N4O7
Smiles	[O-][N+](c(cc1)ccc1C(NNC(COC(C(c(cccc1)c1N1)=CC1=O)=O)=O)=O)=O
InChI	InChI=1S/C19H14N4O7/c24-16-9-14(13-3-1-2-4-15(13)20-16)19(27)30-10-17(25)21-22-18(26)11-5-7-12(8-6-11)23(28)29/h1-9H,10H2,(H,20,24)(H,21,25)(H,22,26)
InChIK	HJXYNJLZWNWGAU-UHFFFAOYSA-N
TotalMolweight	410.341
Molweight	410.341
MonoisotopicMass	410.086251
CLogP	-1.1418
CLogS	-3.66
H Acceptors	11
H Donors	3
TotalSurfaceArea	297.04
Relative PSA	0.42742
PolarSurfaceArea	159.42
Druglikeness	-2.1995
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	high
Nasty Functions	aromatic nitro
Shape Index	0.6
Fragments	1
Non HAtoms	30
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	2
Amides	1
AcidicOxygens	1
StereoCon

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