[(Z)-1-(3-fluorophenyl)-2-[1-(2-phenoxyethyl)benzimidazol-2-yl]ethenyl] 3-fluorobenzoate

Formula:C30H22N2O3F2 Mutagenic:none Tumorigenic:none Reproductive Effective:none [(Z)-1-(3-fluorophenyl)-2-[1-(2-phenoxyethyl)benzimidazol-2-yl]ethenyl] 3-fluorobenzoate is not a drug-like molecule.

MolName[(Z)-1-(3-fluorophenyl)-2-[1-(2-phenoxyethyl)benzimidazol-2-yl]ethenyl] 3-fluorobenzoate
MolecularFormulaC30H22N2O3F2
SmilesO=C(c1cccc(F)c1)O/C(/c1cc(F)ccc1)=C\c1nc(cccc2)c2n1CCOc1ccccc1
InChIInChI=1S/C30H22F2N2O3/c31-23-10-6-8-21(18-23)28(37-30(35)22-9-7-11-24(32)19-22)20-29-33-26-14-4-5-15-27(26)34(29)16-17-36-25-12-2-1-3-13-25/h1-15,18-20H,16-17H2
InChIKVFIUNNCCQOIQNC-UHFFFAOYSA-N
TotalMolweight496.512
Molweight496.512
MonoisotopicMass496.159849
CLogP6.1881
CLogS-5.606
H Acceptors5
TotalSurfaceArea377.78
Relative PSA0.13468
PolarSurfaceArea53.35
Druglikeness1.1522
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.45946
Fragments1
Non HAtoms37
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond9
Rings Closures5
Small Rings5
Aromatic Rings5
Aromatic Atoms27
Sp3Atoms4
Symmetricatoms2
Aromatic Nitrogens2
BasicNitrogens1
StereoCon

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