(4Z)-4-[(2-fluorophenyl)methylidene]-2-[(E)-2-phenylethenyl]-1,3-oxazol-5-one

Formula:C18H12NO2F Mutagenic:none Tumorigenic:none Reproductive Effective:low (4Z)-4-[(2-fluorophenyl)methylidene]-2-[(E)-2-phenylethenyl]-1,3-oxazol-5-one is a drug-like molecule.

MolName(4Z)-4-[(2-fluorophenyl)methylidene]-2-[(E)-2-phenylethenyl]-1,3-oxazol-5-one
MolecularFormulaC18H12NO2F
SmilesO=C1OC(/C=C/c2ccccc2)=N/C1=C\c(cccc1)c1F
InChIInChI=1S/C18H12FNO2/c19-15-9-5-4-8-14(15)12-16-18(21)22-17(20-16)11-10-13-6-2-1-3-7-13/h1-12H
InChIKMORLMODJVARNGG-UHFFFAOYSA-N
TotalMolweight293.296
Molweight293.296
MonoisotopicMass293.085207
CLogP3.0471
CLogS-4.603
H Acceptors3
TotalSurfaceArea227.8
Relative PSA0.15167
PolarSurfaceArea38.66
Druglikeness-0.43777
Mutagenicnone
Tumorigenicnone
Reproductive Effectivelow
Irritantnone
Nasty Functions
Shape Index0.63636
Fragments1
Non HAtoms22
NonCHAtoms4
Electronegative Atoms4
Rotatable Bond3
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms1
Symmetricatoms2
StereoCon

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