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

Formula:C18H13NO4S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-3-(1,3-benzodioxol-5-ylmethyl)-5-[(3-hydroxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one is a drug-like molecule.

MolName	(5Z)-3-(1,3-benzodioxol-5-ylmethyl)-5-[(3-hydroxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
MolecularFormula	C18H13NO4S2
Smiles	Oc1cccc(/C=C(/C(N2Cc(cc3)cc4c3OCO4)=O)\SC2=S)c1
InChI	InChI=1S/C18H13NO4S2/c20-13-3-1-2-11(6-13)8-16-17(21)19(18(24)25-16)9-12-4-5-14-15(7-12)23-10-22-14/h1-8,20H,9-10H2
InChIK	BZVCORLGIRPTFN-UHFFFAOYSA-N
TotalMolweight	371.436
Molweight	371.436
MonoisotopicMass	371.028599
CLogP	2.5809
CLogS	-4.876
H Acceptors	5
H Donors	1
TotalSurfaceArea	262.85
Relative PSA	0.36211
PolarSurfaceArea	116.39
Druglikeness	3.92
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.56
Fragments	1
Non HAtoms	25
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	3
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	7
Amides	1
StereoCon

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