(4E)-2-[(E)-2-(4-nitrophenyl)ethenyl]-4-[(3-nitrophenyl)methylidene]-1,3-oxazol-5-one

Formula:C18H11N3O6 Mutagenic:none Tumorigenic:none Reproductive Effective:none (4E)-2-[(E)-2-(4-nitrophenyl)ethenyl]-4-[(3-nitrophenyl)methylidene]-1,3-oxazol-5-one is a drug-like molecule.

MolName	(4E)-2-[(E)-2-(4-nitrophenyl)ethenyl]-4-[(3-nitrophenyl)methylidene]-1,3-oxazol-5-one
MolecularFormula	C18H11N3O6
Smiles	[O-][N+](c1ccc(/C=C/C(OC2=O)=N/C2=C/c2cccc([N+]([O-])=O)c2)cc1)=O
InChI	InChI=1S/C18H11N3O6/c22-18-16(11-13-2-1-3-15(10-13)21(25)26)19-17(27-18)9-6-12-4-7-14(8-5-12)20(23)24/h1-11H
InChIK	HGAIOIXQNRFCGG-UHFFFAOYSA-N
TotalMolweight	365.3
Molweight	365.3
MonoisotopicMass	365.064787
CLogP	1.1031
CLogS	-5.209
H Acceptors	9
TotalSurfaceArea	268.79
Relative PSA	0.35489
PolarSurfaceArea	130.3
Druglikeness	-4.0981
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.62963
Fragments	1
Non HAtoms	27
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	2
AcidicOxygens	2
StereoCon

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