2-[(E)-2-(4-fluorophenyl)ethenyl]-1H-benzimidazole

Formula:C15H11N2F Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(E)-2-(4-fluorophenyl)ethenyl]-1H-benzimidazole is a drug-like molecule.

MolName2-[(E)-2-(4-fluorophenyl)ethenyl]-1H-benzimidazole
MolecularFormulaC15H11N2F
SmilesFc1ccc(/C=C/c2nc(cccc3)c3[nH]2)cc1
InChIInChI=1S/C15H11FN2/c16-12-8-5-11(6-9-12)7-10-15-17-13-3-1-2-4-14(13)18-15/h1-10H,(H,17,18)
InChIKMNWKLPNORPYJES-UHFFFAOYSA-N
TotalMolweight238.264
Molweight238.264
MonoisotopicMass238.090626
CLogP3.4565
CLogS-3.561
H Acceptors2
H Donors1
TotalSurfaceArea188.8
Relative PSA0.1322
PolarSurfaceArea28.68
Druglikeness-1.306
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.66667
Fragments1
Non HAtoms18
NonCHAtoms3
Electronegative Atoms3
Rotatable Bond2
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms15
Symmetricatoms2
Aromatic Nitrogens2
BasicNitrogens1
StereoCon

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