(2E,6E)-2,6-bis[(4-phenylmethoxyphenyl)methylidene]cyclohexan-1-one

Formula:C34H30O3 Mutagenic:none Tumorigenic:none Reproductive Effective:high (2E,6E)-2,6-bis[(4-phenylmethoxyphenyl)methylidene]cyclohexan-1-one is not a drug-like molecule.

MolName(2E,6E)-2,6-bis[(4-phenylmethoxyphenyl)methylidene]cyclohexan-1-one
MolecularFormulaC34H30O3
SmilesO=C(/C(/CCC1)=C/c(cc2)ccc2OCc2ccccc2)/C1=C/c(cc1)ccc1OCc1ccccc1
InChIInChI=1S/C34H30O3/c35-34-30(22-26-14-18-32(19-15-26)36-24-28-8-3-1-4-9-28)12-7-13-31(34)23-27-16-20-33(21-17-27)37-25-29-10-5-2-6-11-29/h1-6,8-11,14-23H,7,12-13,24-25H2
InChIKCFPVWXYVGJLKGF-UHFFFAOYSA-N
TotalMolweight486.609
Molweight486.609
MonoisotopicMass486.219495
CLogP7.5342
CLogS-7.272
H Acceptors3
TotalSurfaceArea395.01
Relative PSA0.083643
PolarSurfaceArea35.53
Druglikeness-2.3456
Mutagenicnone
Tumorigenicnone
Reproductive Effectivehigh
Irritantnone
Nasty Functions
Shape Index0.67568
Fragments1
Non HAtoms37
NonCHAtoms3
Electronegative Atoms3
Rotatable Bond8
Rings Closures5
Small Rings5
Aromatic Rings4
Aromatic Atoms24
Sp3Atoms7
Symmetricatoms21
StereoCon

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