3-naphthalen-2-yl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinazolin-4-one

Formula:C24H15N3O4 Mutagenic:high Tumorigenic:high Reproductive Effective:none 3-naphthalen-2-yl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinazolin-4-one is a drug-like molecule.

MolName	3-naphthalen-2-yl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinazolin-4-one
MolecularFormula	C24H15N3O4
Smiles	[O-][N+](c1ccc(/C=C/C(N2c3cc4ccccc4cc3)=Nc(cccc3)c3C2=O)o1)=O
InChI	InChI=1S/C24H15N3O4/c28-24-20-7-3-4-8-21(20)25-22(13-11-19-12-14-23(31-19)27(29)30)26(24)18-10-9-16-5-1-2-6-17(16)15-18/h1-15H
InChIK	PDLDXEZZYPPKQU-UHFFFAOYSA-N
TotalMolweight	409.4
Molweight	409.4
MonoisotopicMass	409.106257
CLogP	4.123
CLogS	-7.331
H Acceptors	7
TotalSurfaceArea	304.76
Relative PSA	0.23832
PolarSurfaceArea	91.63
Druglikeness	-1.067
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.48387
Fragments	1
Non HAtoms	31
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	1
Amides	1
AcidicOxygens	1
StereoCon

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