(E)-1-(2-chlorophenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one

Formula:C15H11O2Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-1-(2-chlorophenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one is a drug-like molecule.

MolName(E)-1-(2-chlorophenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one
MolecularFormulaC15H11O2Cl
SmilesOc1ccc(/C=C/C(c(cccc2)c2Cl)=O)cc1
InChIInChI=1S/C15H11ClO2/c16-14-4-2-1-3-13(14)15(18)10-7-11-5-8-12(17)9-6-11/h1-10,17H
InChIKFDGQCKIOOCJPLO-UHFFFAOYSA-N
TotalMolweight258.703
Molweight258.703
MonoisotopicMass258.044757
CLogP3.5641
CLogS-4.28
H Acceptors2
H Donors1
TotalSurfaceArea199.04
Relative PSA0.13133
PolarSurfaceArea37.3
Druglikeness0.22165
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.66667
Fragments1
Non HAtoms18
NonCHAtoms3
Electronegative Atoms3
Rotatable Bond3
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms1
Symmetricatoms2
StereoCon

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