(5Z)-5-[[4-[(4-fluorophenyl)methoxy]phenyl]methylidene]-1,3-thiazolidine-2,4-dione

Formula:C17H12NO3FS Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-5-[[4-[(4-fluorophenyl)methoxy]phenyl]methylidene]-1,3-thiazolidine-2,4-dione is a drug-like molecule.

MolName(5Z)-5-[[4-[(4-fluorophenyl)methoxy]phenyl]methylidene]-1,3-thiazolidine-2,4-dione
MolecularFormulaC17H12NO3FS
SmilesO=C(/C(/S1)=C/c(cc2)ccc2OCc(cc2)ccc2F)NC1=O
InChIInChI=1S/C17H12FNO3S/c18-13-5-1-12(2-6-13)10-22-14-7-3-11(4-8-14)9-15-16(20)19-17(21)23-15/h1-9H,10H2,(H,19,20,21)
InChIKVQFLEQLTMBREFT-UHFFFAOYSA-N
TotalMolweight329.35
Molweight329.35
MonoisotopicMass329.052192
CLogP2.9383
CLogS-4.804
H Acceptors4
H Donors1
TotalSurfaceArea238.79
Relative PSA0.27233
PolarSurfaceArea80.7
Druglikeness1.4455
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionslimit! methylene-thiazolidine-2,4-dione
Shape Index0.69565
Fragments1
Non HAtoms23
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond4
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms3
Symmetricatoms4
Amides1
StereoCon

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