(5E)-5-(1,2-oxazol-3-ylmethylidene)-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one

Formula:C13H8N2O2S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (5E)-5-(1,2-oxazol-3-ylmethylidene)-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one is a drug-like molecule.

MolName(5E)-5-(1,2-oxazol-3-ylmethylidene)-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one
MolecularFormulaC13H8N2O2S2
SmilesO=C(/C(/SC1=S)=C\c2nocc2)N1c1ccccc1
InChIInChI=1S/C13H8N2O2S2/c16-12-11(8-9-6-7-17-14-9)19-13(18)15(12)10-4-2-1-3-5-10/h1-8H
InChIKJBSVUTVLRODGTK-UHFFFAOYSA-N
TotalMolweight288.351
Molweight288.351
MonoisotopicMass288.002718
CLogP1.3566
CLogS-4.104
H Acceptors4
TotalSurfaceArea210.93
Relative PSA0.41322
PolarSurfaceArea103.73
Druglikeness3.9327
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.57895
Fragments1
Non HAtoms19
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond2
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms11
Sp3Atoms2
Symmetricatoms2
Amides1
Aromatic Nitrogens1
StereoCon

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