(4Z)-4-[(2-hydroxy-5-nitrophenyl)methylidene]-2-(3-nitrophenyl)-1,3-oxazol-5-one

Formula:C16H9N3O7 Mutagenic:none Tumorigenic:none Reproductive Effective:none (4Z)-4-[(2-hydroxy-5-nitrophenyl)methylidene]-2-(3-nitrophenyl)-1,3-oxazol-5-one is a drug-like molecule.

MolName	(4Z)-4-[(2-hydroxy-5-nitrophenyl)methylidene]-2-(3-nitrophenyl)-1,3-oxazol-5-one
MolecularFormula	C16H9N3O7
Smiles	[O-][N+](c1cccc(C(OC2=O)=N/C2=C\c(cc(cc2)[N+]([O-])=O)c2O)c1)=O
InChI	InChI=1S/C16H9N3O7/c20-14-5-4-12(19(24)25)7-10(14)8-13-16(21)26-15(17-13)9-2-1-3-11(6-9)18(22)23/h1-8,20H
InChIK	UHFSEEAJAUWGKK-UHFFFAOYSA-N
TotalMolweight	355.261
Molweight	355.261
MonoisotopicMass	355.044052
CLogP	0.4029
CLogS	-4.543
H Acceptors	10
H Donors	1
TotalSurfaceArea	248.64
Relative PSA	0.43633
PolarSurfaceArea	150.53
Druglikeness	-4.1148
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.53846
Fragments	1
Non HAtoms	26
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
AcidicOxygens	2
StereoCon

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