2-[(5Z)-4-oxo-5-[[5-(4-sulfamoylphenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid

Formula:C16H12N2O6S3 Mutagenic:high Tumorigenic:high Reproductive Effective:none 2-[(5Z)-4-oxo-5-[[5-(4-sulfamoylphenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid is a drug-like molecule.

MolName	2-[(5Z)-4-oxo-5-[[5-(4-sulfamoylphenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid
MolecularFormula	C16H12N2O6S3
Smiles	NS(c(cc1)ccc1-c1ccc(/C=C(/C(N2CC(O)=O)=O)\SC2=S)o1)(=O)=O
InChI	InChI=1S/C16H12N2O6S3/c17-27(22,23)11-4-1-9(2-5-11)12-6-3-10(24-12)7-13-15(21)18(8-14(19)20)16(25)26-13/h1-7H,8H2,(H,19,20)(H2,17,22,23)
InChIK	INTRPSYVRVQXSB-UHFFFAOYSA-N
TotalMolweight	424.477
Molweight	424.477
MonoisotopicMass	423.985748
CLogP	0.23
CLogS	-4.272
H Acceptors	8
H Donors	2
TotalSurfaceArea	287.13
Relative PSA	0.50911
PolarSurfaceArea	196.68
Druglikeness	0.78468
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.59259
Fragments	1
Non HAtoms	27
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	5
Symmetricatoms	3
Amides	2
AcidicOxygens	1
StereoCon

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1 - 2-[(5Z)-4-oxo-5-[[5-(4-sulfamoylphenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid | 2 - 2-[(5Z)-4-oxo-5-[[5-(4-sulfamoylphenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid

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