(5E)-5-[[2-(2,4-dichlorophenoxy)phenyl]methylidene]-1,3-thiazolidine-2,4-dione

Formula:C16H9NO3Cl2S Mutagenic:none Tumorigenic:high Reproductive Effective:high (5E)-5-[[2-(2,4-dichlorophenoxy)phenyl]methylidene]-1,3-thiazolidine-2,4-dione is a drug-like molecule.

MolName	(5E)-5-[[2-(2,4-dichlorophenoxy)phenyl]methylidene]-1,3-thiazolidine-2,4-dione
MolecularFormula	C16H9NO3Cl2S
Smiles	O=C(/C(/S1)=C\c(cccc2)c2Oc(ccc(Cl)c2)c2Cl)NC1=O
InChI	InChI=1S/C16H9Cl2NO3S/c17-10-5-6-13(11(18)8-10)22-12-4-2-1-3-9(12)7-14-15(20)19-16(21)23-14/h1-8H,(H,19,20,21)
InChIK	METPZWLXKKBBOY-UHFFFAOYSA-N
TotalMolweight	366.223
Molweight	366.223
MonoisotopicMass	364.968018
CLogP	4.097
CLogS	-6.918
H Acceptors	4
H Donors	1
TotalSurfaceArea	249.52
Relative PSA	0.26062
PolarSurfaceArea	80.7
Druglikeness	3.032
Mutagenic	none
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	limit! methylene-thiazolidine-2,4-dione
Shape Index	0.56522
Fragments	1
Non HAtoms	23
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Amides	1
StereoCon

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