2-[(E)-2-(4-fluorophenyl)ethenyl]-5-phenyl-1,3,4-oxadiazole

Formula:C16H11N2OF Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(E)-2-(4-fluorophenyl)ethenyl]-5-phenyl-1,3,4-oxadiazole is a drug-like molecule.

MolName2-[(E)-2-(4-fluorophenyl)ethenyl]-5-phenyl-1,3,4-oxadiazole
MolecularFormulaC16H11N2OF
SmilesFc1ccc(/C=C/c2nnc(-c3ccccc3)o2)cc1
InChIInChI=1S/C16H11FN2O/c17-14-9-6-12(7-10-14)8-11-15-18-19-16(20-15)13-4-2-1-3-5-13/h1-11H
InChIKZFOXOACDULQWMY-UHFFFAOYSA-N
TotalMolweight266.274
Molweight266.274
MonoisotopicMass266.085541
CLogP3.682
CLogS-5.079
H Acceptors3
TotalSurfaceArea212.84
Relative PSA0.16938
PolarSurfaceArea38.92
Druglikeness-1.0357
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.7
Fragments1
Non HAtoms20
NonCHAtoms4
Electronegative Atoms4
Rotatable Bond3
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms17
Symmetricatoms4
Aromatic Nitrogens2
StereoCon

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