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

Formula:C20H12N2O4S2 Mutagenic:high Tumorigenic:high Reproductive Effective:none (5E)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one is a drug-like molecule.

MolName	(5E)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one
MolecularFormula	C20H12N2O4S2
Smiles	[O-][N+](c1cccc(-c2ccc(/C=C(\C(N3c4ccccc4)=O)/SC3=S)o2)c1)=O
InChI	InChI=1S/C20H12N2O4S2/c23-19-18(28-20(27)21(19)14-6-2-1-3-7-14)12-16-9-10-17(26-16)13-5-4-8-15(11-13)22(24)25/h1-12H
InChIK	OUVKDNSZSHZDQN-UHFFFAOYSA-N
TotalMolweight	408.457
Molweight	408.457
MonoisotopicMass	408.023848
CLogP	2.9096
CLogS	-6.903
H Acceptors	6
TotalSurfaceArea	295.6
Relative PSA	0.36066
PolarSurfaceArea	136.66
Druglikeness	-1.2512
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.57143
Fragments	1
Non HAtoms	28
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	3
Symmetricatoms	2
Amides	1
AcidicOxygens	1
StereoCon

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