[2-[2-(4-nitrobenzoyl)hydrazinyl]-2-oxoethyl] 2-(furan-2-ylmethyl)-1,3-dioxoisoindole-5-carboxylate

Formula:C23H16N4O9 Mutagenic:none Tumorigenic:none Reproductive Effective:none [2-[2-(4-nitrobenzoyl)hydrazinyl]-2-oxoethyl] 2-(furan-2-ylmethyl)-1,3-dioxoisoindole-5-carboxylate is not a drug-like molecule.

MolName	[2-[2-(4-nitrobenzoyl)hydrazinyl]-2-oxoethyl] 2-(furan-2-ylmethyl)-1,3-dioxoisoindole-5-carboxylate
MolecularFormula	C23H16N4O9
Smiles	[O-][N+](c(cc1)ccc1C(NNC(COC(c(cc1)cc(C(N2Cc3ccco3)=O)c1C2=O)=O)=O)=O)=O
InChI	InChI=1S/C23H16N4O9/c28-19(24-25-20(29)13-3-6-15(7-4-13)27(33)34)12-36-23(32)14-5-8-17-18(10-14)22(31)26(21(17)30)11-16-2-1-9-35-16/h1-10H,11-12H2,(H,24,28)(H,25,29)
InChIK	GXCALXXUPKHVIC-UHFFFAOYSA-N
TotalMolweight	492.399
Molweight	492.399
MonoisotopicMass	492.091731
CLogP	0.1947
CLogS	-4.687
H Acceptors	13
H Donors	2
TotalSurfaceArea	352.13
Relative PSA	0.41519
PolarSurfaceArea	180.84
Druglikeness	-0.040391
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.61111
Fragments	1
Non HAtoms	36
NonCHAtoms	13
Electronegative Atoms	13
Rotatable Bond	9
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	4
Symmetricatoms	2
Amides	1
AcidicOxygens	1
StereoCon

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