(1E,4E)-1-(2-hydroxyphenyl)-5-phenylpenta-1,4-dien-3-one

Formula:C17H14O2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (1E,4E)-1-(2-hydroxyphenyl)-5-phenylpenta-1,4-dien-3-one is a drug-like molecule.

MolName(1E,4E)-1-(2-hydroxyphenyl)-5-phenylpenta-1,4-dien-3-one
MolecularFormulaC17H14O2
SmilesOc1c(/C=C/C(/C=C/c2ccccc2)=O)cccc1
InChIInChI=1S/C17H14O2/c18-16(12-10-14-6-2-1-3-7-14)13-11-15-8-4-5-9-17(15)19/h1-13,19H
InChIKFDFRSFSHWUDRTJ-UHFFFAOYSA-N
TotalMolweight250.296
Molweight250.296
MonoisotopicMass250.09938
CLogP3.5789
CLogS-3.69
H Acceptors2
H Donors1
TotalSurfaceArea210.12
Relative PSA0.12441
PolarSurfaceArea37.3
Druglikeness0.68383
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.68421
Fragments1
Non HAtoms19
NonCHAtoms2
Electronegative Atoms2
Rotatable Bond4
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms1
Symmetricatoms2
StereoCon

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