1-[[(5Z)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]methyl]pyrrolidine-2,5-dione

Formula:C13H10N2O4S2 Mutagenic:high Tumorigenic:none Reproductive Effective:none 1-[[(5Z)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]methyl]pyrrolidine-2,5-dione is a drug-like molecule.

MolName	1-[[(5Z)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]methyl]pyrrolidine-2,5-dione
MolecularFormula	C13H10N2O4S2
Smiles	O=C(CC1)N(CN(C(/C(/S2)=C/c3ccco3)=O)C2=S)C1=O
InChI	InChI=1S/C13H10N2O4S2/c16-10-3-4-11(17)14(10)7-15-12(18)9(21-13(15)20)6-8-2-1-5-19-8/h1-2,5-6H,3-4,7H2
InChIK	FIYJAPRSOLFOQQ-UHFFFAOYSA-N
TotalMolweight	322.364
Molweight	322.364
MonoisotopicMass	322.008198
CLogP	-0.0364
CLogS	-3.422
H Acceptors	6
TotalSurfaceArea	225.99
Relative PSA	0.46825
PolarSurfaceArea	128.22
Druglikeness	-1.9864
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	methanediamine
Shape Index	0.52381
Fragments	1
Non HAtoms	21
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	1
Aromatic Atoms	5
Sp3Atoms	5
Symmetricatoms	3
Amides	2
StereoCon

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1 - 1-[[(5Z)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]methyl]pyrrolidine-2,5-dione | 2 - 1-[[(5Z)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]methyl]pyrrolidine-2,5-dione

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