[(Z)-1,2-diphenylethenyl]sulfonylmethylbenzene

Formula:C21H18O2S Mutagenic:none Tumorigenic:low Reproductive Effective:low [(Z)-1,2-diphenylethenyl]sulfonylmethylbenzene is a drug-like molecule.

MolName[(Z)-1,2-diphenylethenyl]sulfonylmethylbenzene
MolecularFormulaC21H18O2S
SmilesO=S(Cc1ccccc1)(/C(/c1ccccc1)=C\c1ccccc1)=O
InChIInChI=1S/C21H18O2S/c22-24(23,17-19-12-6-2-7-13-19)21(20-14-8-3-9-15-20)16-18-10-4-1-5-11-18/h1-16H,17H2
InChIKONFIELJYPYBFER-UHFFFAOYSA-N
TotalMolweight334.438
Molweight334.438
MonoisotopicMass334.10275
CLogP4.0767
CLogS-3.899
H Acceptors2
TotalSurfaceArea259.83
Relative PSA0.11
PolarSurfaceArea42.52
Druglikeness-7.0635
Mutagenicnone
Tumorigeniclow
Reproductive Effectivelow
Irritantnone
Nasty Functions
Shape Index0.5
Fragments1
Non HAtoms24
NonCHAtoms3
Electronegative Atoms3
Rotatable Bond5
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms2
Symmetricatoms7
StereoCon

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