(5Z)-5-[[2-(4-bromo-2-fluorophenoxy)phenyl]methylidene]-1,3-thiazolidine-2,4-dione

Formula:C16H9NO3BrFS Mutagenic:high Tumorigenic:none Reproductive Effective:none (5Z)-5-[[2-(4-bromo-2-fluorophenoxy)phenyl]methylidene]-1,3-thiazolidine-2,4-dione is a drug-like molecule.

MolName	(5Z)-5-[[2-(4-bromo-2-fluorophenoxy)phenyl]methylidene]-1,3-thiazolidine-2,4-dione
MolecularFormula	C16H9NO3BrFS
Smiles	O=C(/C(/S1)=C/c(cccc2)c2Oc(ccc(Br)c2)c2F)NC1=O
InChI	InChI=1S/C16H9BrFNO3S/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	LZJWFTRBKBDIFT-UHFFFAOYSA-N
TotalMolweight	394.219
Molweight	394.219
MonoisotopicMass	392.947053
CLogP	3.711
CLogS	-6.594
H Acceptors	4
H Donors	1
TotalSurfaceArea	243.66
Relative PSA	0.26689
PolarSurfaceArea	80.7
Druglikeness	-0.15705
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
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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1 - (5Z)-5-[[2-(4-bromo-2-fluorophenoxy)phenyl]methylidene]-1,3-thiazolidine-2,4-dione | 2 - (5Z)-5-[[2-(4-bromo-2-fluorophenoxy)phenyl]methylidene]-1,3-thiazolidine-2,4-dione

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