(5E)-3-[(4-fluorophenyl)methyl]-5-[(5-morpholin-4-ylfuran-2-yl)methylidene]-1,3-thiazolidine-2,4-dione

Formula:C19H17N2O4FS Mutagenic:high Tumorigenic:high Reproductive Effective:none (5E)-3-[(4-fluorophenyl)methyl]-5-[(5-morpholin-4-ylfuran-2-yl)methylidene]-1,3-thiazolidine-2,4-dione is a drug-like molecule.

MolName(5E)-3-[(4-fluorophenyl)methyl]-5-[(5-morpholin-4-ylfuran-2-yl)methylidene]-1,3-thiazolidine-2,4-dione
MolecularFormulaC19H17N2O4FS
SmilesO=C(/C(/S1)=C\c2ccc(N3CCOCC3)o2)N(Cc(cc2)ccc2F)C1=O
InChIInChI=1S/C19H17FN2O4S/c20-14-3-1-13(2-4-14)12-22-18(23)16(27-19(22)24)11-15-5-6-17(26-15)21-7-9-25-10-8-21/h1-6,11H,7-10,12H2
InChIKWTIBRRQFRBSGKK-UHFFFAOYSA-N
TotalMolweight388.418
Molweight388.418
MonoisotopicMass388.089306
CLogP2.4703
CLogS-4.734
H Acceptors6
TotalSurfaceArea279.16
Relative PSA0.26788
PolarSurfaceArea88.29
Druglikeness3.4819
Mutagenichigh
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functionslimit! methylene-thiazolidine-2,4-dione
Shape Index0.62963
Fragments1
Non HAtoms27
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond4
Rings Closures4
Small Rings4
Aromatic Rings2
Aromatic Atoms11
Sp3Atoms7
Symmetricatoms4
Amides1
StereoCon

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