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

Formula:C15H11O2F Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(4-fluorophenyl)-1-(4-hydroxyphenyl)prop-2-en-1-one is a drug-like molecule.

MolName(E)-3-(4-fluorophenyl)-1-(4-hydroxyphenyl)prop-2-en-1-one
MolecularFormulaC15H11O2F
SmilesOc(cc1)ccc1C(/C=C/c(cc1)ccc1F)=O
InChIInChI=1S/C15H11FO2/c16-13-6-1-11(2-7-13)3-10-15(18)12-4-8-14(17)9-5-12/h1-10,17H
InChIKNDVVHDJUSWOVOP-UHFFFAOYSA-N
TotalMolweight242.248
Molweight242.248
MonoisotopicMass242.074308
CLogP3.0589
CLogS-3.858
H Acceptors2
H Donors1
TotalSurfaceArea189.97
Relative PSA0.1376
PolarSurfaceArea37.3
Druglikeness-1.2064
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.72222
Fragments1
Non HAtoms18
NonCHAtoms3
Electronegative Atoms3
Rotatable Bond3
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms1
Symmetricatoms4
StereoCon

Request More Details | (E)-3-(4-fluorophenyl)-1-(4-hydroxyphenyl)prop-2-en-1-one


SKU Product Name Product Unit Qty Supplier Email
User Name
User Email
Additional Comments