(5E)-3-anilino-5-[(2-hydroxy-5-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Formula:C16H11N3O4S2 Mutagenic:none Tumorigenic:high Reproductive Effective:low (5E)-3-anilino-5-[(2-hydroxy-5-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one is a drug-like molecule.

MolName	(5E)-3-anilino-5-[(2-hydroxy-5-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
MolecularFormula	C16H11N3O4S2
Smiles	[O-][N+](c(cc1)cc(/C=C(\C(N2Nc3ccccc3)=O)/SC2=S)c1O)=O
InChI	InChI=1S/C16H11N3O4S2/c20-13-7-6-12(19(22)23)8-10(13)9-14-15(21)18(16(24)25-14)17-11-4-2-1-3-5-11/h1-9,17,20H
InChIK	FLLUXJPPOMOUKI-UHFFFAOYSA-N
TotalMolweight	373.412
Molweight	373.412
MonoisotopicMass	373.019097
CLogP	1.8432
CLogS	-4.276
H Acceptors	7
H Donors	2
TotalSurfaceArea	263.96
Relative PSA	0.44348
PolarSurfaceArea	155.78
Druglikeness	-1.6575
Mutagenic	none
Tumorigenic	high
Reproductive Effective	low
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.56
Fragments	1
Non HAtoms	25
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
Symmetricatoms	2
AcidicOxygens	1
StereoCon

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