(Z)-3-hydroxy-1,3-dithiophen-2-ylprop-2-en-1-one

Formula:C11H8O2S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-3-hydroxy-1,3-dithiophen-2-ylprop-2-en-1-one is a drug-like molecule.

MolName	(Z)-3-hydroxy-1,3-dithiophen-2-ylprop-2-en-1-one
MolecularFormula	C11H8O2S2
Smiles	O/C(/c1cccs1)=C\C(c1cccs1)=O
InChI	InChI=1S/C11H8O2S2/c12-8(10-3-1-5-14-10)7-9(13)11-4-2-6-15-11/h1-7,12H
InChIK	LSZVMHRIKBGPFO-UHFFFAOYSA-N
TotalMolweight	236.315
Molweight	236.315
MonoisotopicMass	235.99657
CLogP	2.3319
CLogS	-3.393
H Acceptors	2
H Donors	1
TotalSurfaceArea	173.71
Relative PSA	0.38489
PolarSurfaceArea	93.78
Druglikeness	2.9179
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6
Fragments	1
Non HAtoms	15
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	10
Sp3Atoms	1
StereoCon

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