(5Z)-3-(1,3-benzodioxol-5-yl)-2-(1,3-benzodioxol-5-ylimino)-5-[(4-hydroxyphenyl)methylidene]-1,3-thiazolidin-4-one

Formula:C24H16N2O6S Mutagenic:none Tumorigenic:none Reproductive Effective:high (5Z)-3-(1,3-benzodioxol-5-yl)-2-(1,3-benzodioxol-5-ylimino)-5-[(4-hydroxyphenyl)methylidene]-1,3-thiazolidin-4-one is a drug-like molecule.

MolName	(5Z)-3-(1,3-benzodioxol-5-yl)-2-(1,3-benzodioxol-5-ylimino)-5-[(4-hydroxyphenyl)methylidene]-1,3-thiazolidin-4-one
MolecularFormula	C24H16N2O6S
Smiles	Oc1ccc(/C=C(/C(N2c(cc3)cc4c3OCO4)=O)\S/C2=N\c(cc2)cc3c2OCO3)cc1
InChI	InChI=1S/C24H16N2O6S/c27-17-5-1-14(2-6-17)9-22-23(28)26(16-4-8-19-21(11-16)32-13-30-19)24(33-22)25-15-3-7-18-20(10-15)31-12-29-18/h1-11,27H,12-13H2
InChIK	XBLCCTBZWIHIRH-UHFFFAOYSA-N
TotalMolweight	460.465
Molweight	460.465
MonoisotopicMass	460.072908
CLogP	4.5551
CLogS	-6.976
H Acceptors	8
H Donors	1
TotalSurfaceArea	319.37
Relative PSA	0.30901
PolarSurfaceArea	115.12
Druglikeness	3.3044
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.45455
Fragments	1
Non HAtoms	33
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	3
Rings Closures	6
Small Rings	6
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	8
Symmetricatoms	2
Amides	1
StereoCon

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1 - (5Z)-3-(1,3-benzodioxol-5-yl)-2-(1,3-benzodioxol-5-ylimino)-5-[(4-hydroxyphenyl)methylidene]-1,3-thiazolidin-4-one | 2 - (5Z)-3-(1,3-benzodioxol-5-yl)-2-(1,3-benzodioxol-5-ylimino)-5-[(4-hydroxyphenyl)methylidene]-1,3-thiazolidin-4-one

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