(1Z,9Z)-4,4,5,5,6,6,7,7-octafluoro-1,10-dihydroxy-1,10-diphenyldeca-1,9-diene-3,8-dione

Formula:C22H14O4F8 Mutagenic:none Tumorigenic:none Reproductive Effective:none (1Z,9Z)-4,4,5,5,6,6,7,7-octafluoro-1,10-dihydroxy-1,10-diphenyldeca-1,9-diene-3,8-dione is a drug-like molecule.

MolName(1Z,9Z)-4,4,5,5,6,6,7,7-octafluoro-1,10-dihydroxy-1,10-diphenyldeca-1,9-diene-3,8-dione
MolecularFormulaC22H14O4F8
SmilesO/C(/c1ccccc1)=C\C(C(C(C(C(C(/C=C(/c1ccccc1)\O)=O)(F)F)(F)F)(F)F)(F)F)=O
InChIInChI=1S/C22H14F8O4/c23-19(24,17(33)11-15(31)13-7-3-1-4-8-13)21(27,28)22(29,30)20(25,26)18(34)12-16(32)14-9-5-2-6-10-14/h1-12,31-32H
InChIKNHLMYTLBAXSNQA-UHFFFAOYSA-N
TotalMolweight494.333
Molweight494.333
MonoisotopicMass494.076434
CLogP4.7518
CLogS-5.846
H Acceptors4
H Donors2
TotalSurfaceArea323.08
Relative PSA0.16182
PolarSurfaceArea74.6
Druglikeness-86.097
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.52941
Fragments1
Non HAtoms34
NonCHAtoms12
Electronegative Atoms12
Rotatable Bond9
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms6
Symmetricatoms21
StereoCon

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