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

Formula:C20H11N2O4FS2 Mutagenic:high Tumorigenic:high Reproductive Effective:none (5E)-3-(3-fluorophenyl)-5-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one is a drug-like molecule.

MolName	(5E)-3-(3-fluorophenyl)-5-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
MolecularFormula	C20H11N2O4FS2
Smiles	[O-][N+](c(cc1)ccc1-c1ccc(/C=C(\C(N2c3cc(F)ccc3)=O)/SC2=S)o1)=O
InChI	InChI=1S/C20H11FN2O4S2/c21-13-2-1-3-15(10-13)22-19(24)18(29-20(22)28)11-16-8-9-17(27-16)12-4-6-14(7-5-12)23(25)26/h1-11H
InChIK	YCQVGLDANOECHF-UHFFFAOYSA-N
TotalMolweight	426.447
Molweight	426.447
MonoisotopicMass	426.014426
CLogP	3.0104
CLogS	-7.217
H Acceptors	6
TotalSurfaceArea	301.95
Relative PSA	0.35307
PolarSurfaceArea	136.66
Druglikeness	-2.5912
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.58621
Fragments	1
Non HAtoms	29
NonCHAtoms	9
Electronegative Atoms	9
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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