(5E)-5-[(5-bromo-3-chloro-2-hydroxyphenyl)methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one

Formula:C16H9NO2BrClS2 Mutagenic:low Tumorigenic:none Reproductive Effective:low (5E)-5-[(5-bromo-3-chloro-2-hydroxyphenyl)methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one is a drug-like molecule.

MolName	(5E)-5-[(5-bromo-3-chloro-2-hydroxyphenyl)methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one
MolecularFormula	C16H9NO2BrClS2
Smiles	Oc(c(/C=C(\C(N1c2ccccc2)=O)/SC1=S)cc(Br)c1)c1Cl
InChI	InChI=1S/C16H9BrClNO2S2/c17-10-6-9(14(20)12(18)8-10)7-13-15(21)19(16(22)23-13)11-4-2-1-3-5-11/h1-8,20H
InChIK	AORDDZSDURWULY-UHFFFAOYSA-N
TotalMolweight	426.741
Molweight	426.741
MonoisotopicMass	424.894657
CLogP	3.8778
CLogS	-6.257
H Acceptors	3
H Donors	1
TotalSurfaceArea	262.88
Relative PSA	0.28599
PolarSurfaceArea	97.93
Druglikeness	1.0594
Mutagenic	low
Tumorigenic	none
Reproductive Effective	low
Irritant	none
Nasty Functions
Shape Index	0.52174
Fragments	1
Non HAtoms	23
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	2
Amides	1
StereoCon

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