2-[[(5Z)-5-[(2-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]amino]benzoic acid

Formula:C18H14N2O4S2 Mutagenic:none Tumorigenic:none Reproductive Effective:low 2-[[(5Z)-5-[(2-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]amino]benzoic acid is a drug-like molecule.

MolName	2-[[(5Z)-5-[(2-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]amino]benzoic acid
MolecularFormula	C18H14N2O4S2
Smiles	COc1c(/C=C(/C(N2Nc(cccc3)c3C(O)=O)=O)\SC2=S)cccc1
InChI	InChI=1S/C18H14N2O4S2/c1-24-14-9-5-2-6-11(14)10-15-16(21)20(18(25)26-15)19-13-8-4-3-7-12(13)17(22)23/h2-10,19H,1H3,(H,22,23)/b15-10-
InChIK	RRKXAACEOKETBA-GDNBJRDFSA-N
TotalMolweight	386.451
Molweight	386.451
MonoisotopicMass	386.039498
CLogP	2.5256
CLogS	-4.143
H Acceptors	6
H Donors	2
TotalSurfaceArea	280.3
Relative PSA	0.3913
PolarSurfaceArea	136.26
Druglikeness	3.3724
Mutagenic	none
Tumorigenic	none
Reproductive Effective	low
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	26
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	5
AcidicOxygens	1
StereoCon

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1 - 2-[[(5Z)-5-[(2-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]amino]benzoic acid | 2 - 2-[[(5Z)-5-[(2-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]amino]benzoic acid

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