5-[(4-hydroxyphenyl)methylidene]-3-(2-methoxyphenyl)-1,3-thiazolidine-2,4-dione

Formula:C17H13NO4S Mutagenic:none Tumorigenic:none Reproductive Effective:high 5-[(4-hydroxyphenyl)methylidene]-3-(2-methoxyphenyl)-1,3-thiazolidine-2,4-dione is a drug-like molecule.

MolName	5-[(4-hydroxyphenyl)methylidene]-3-(2-methoxyphenyl)-1,3-thiazolidine-2,4-dione
MolecularFormula	C17H13NO4S
Smiles	COc(cccc1)c1N(C(C(S1)=Cc(cc2)ccc2O)=O)C1=O
InChI	InChI=1S/C17H13NO4S/c1-22-14-5-3-2-4-13(14)18-16(20)15(23-17(18)21)10-11-6-8-12(19)9-7-11/h2-10,19H,1H3
InChIK	AJOPSTPIQOVNEX-UHFFFAOYSA-N
TotalMolweight	327.359
Molweight	327.359
MonoisotopicMass	327.056529
CLogP	2.8218
CLogS	-4.354
H Acceptors	5
H Donors	1
TotalSurfaceArea	236.13
Relative PSA	0.29738
PolarSurfaceArea	92.14
Druglikeness	3.2492
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	limit! methylene-thiazolidine-2,4-dione
Shape Index	0.56522
Fragments	1
Non HAtoms	23
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
Symmetricatoms	2
Amides	1
StereoCon

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