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(5Z)-5-(furan-2-ylmethylidene)-3-[3-[(5Z)-5-(furan-2-ylmethylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]-2-oxopropyl]-1,3-thiazolidine-2,4-dione

Formula:C19H12N2O7S2 Mutagenic:high Tumorigenic:none Reproductive Effective:none (5Z)-5-(furan-2-ylmethylidene)-3-[3-[(5Z)-5-(furan-2-ylmethylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]-2-oxopropyl]-1,3-thiazolidine-2,4-dione is a drug-like molecule.
MolName(5Z)-5-(furan-2-ylmethylidene)-3-[3-[(5Z)-5-(furan-2-ylmethylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]-2-oxopropyl]-1,3-thiazolidine-2,4-dione
MolecularFormulaC19H12N2O7S2
SmilesO=C(CN(C(/C(/S1)=C/c2ccco2)=O)C1=O)CN(C(/C(/S1)=C/c2ccco2)=O)C1=O
InChIInChI=1S/C19H12N2O7S2/c22-11(9-20-16(23)14(29-18(20)25)7-12-3-1-5-27-12)10-21-17(24)15(30-19(21)26)8-13-4-2-6-28-13/h1-8H,9-10H2
InChIKSQORPIHDUQPKRD-UHFFFAOYSA-N
TotalMolweight444.443
Molweight444.443
MonoisotopicMass444.008593
CLogP1.0988
CLogS-4.476
H Acceptors9
TotalSurfaceArea306.67
Relative PSA0.44184
PolarSurfaceArea168.71
Druglikeness4.7248
Mutagenichigh
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionslimit! methylene-thiazolidine-2,4-dione
Shape Index0.56667
Fragments1
Non HAtoms30
NonCHAtoms11
Electronegative Atoms11
Rotatable Bond6
Rings Closures4
Small Rings4
Aromatic Rings2
Aromatic Atoms10
Sp3Atoms4
Symmetricatoms14
Amides2
StereoCon

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