(5E)-5-[(5-nitrofuran-2-yl)methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one

Formula:C14H8N2O4S2 Mutagenic:high Tumorigenic:high Reproductive Effective:none (5E)-5-[(5-nitrofuran-2-yl)methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one is a drug-like molecule.

MolName	(5E)-5-[(5-nitrofuran-2-yl)methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one
MolecularFormula	C14H8N2O4S2
Smiles	[O-][N+](c1ccc(/C=C(\C(N2c3ccccc3)=O)/SC2=S)o1)=O
InChI	InChI=1S/C14H8N2O4S2/c17-13-11(8-10-6-7-12(20-10)16(18)19)22-14(21)15(13)9-4-2-1-3-5-9/h1-8H
InChIK	BBUPARLMPYRUDR-UHFFFAOYSA-N
TotalMolweight	332.36
Molweight	332.36
MonoisotopicMass	331.992548
CLogP	1.5108
CLogS	-5.65
H Acceptors	6
TotalSurfaceArea	235.84
Relative PSA	0.45204
PolarSurfaceArea	136.66
Druglikeness	-0.43234
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.59091
Fragments	1
Non HAtoms	22
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	3
Symmetricatoms	2
Amides	1
AcidicOxygens	1
StereoCon

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