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

Formula:C19H19NO3 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(4-hydroxyphenyl)-1-(4-morpholin-4-ylphenyl)prop-2-en-1-one is a drug-like molecule.

MolName(E)-3-(4-hydroxyphenyl)-1-(4-morpholin-4-ylphenyl)prop-2-en-1-one
MolecularFormulaC19H19NO3
SmilesOc1ccc(/C=C/C(c(cc2)ccc2N2CCOCC2)=O)cc1
InChIInChI=1S/C19H19NO3/c21-18-8-1-15(2-9-18)3-10-19(22)16-4-6-17(7-5-16)20-11-13-23-14-12-20/h1-10,21H,11-14H2
InChIKQEXKKEBOKKNSMO-UHFFFAOYSA-N
TotalMolweight309.364
Molweight309.364
MonoisotopicMass309.136494
CLogP2.6271
CLogS-3.647
H Acceptors4
H Donors1
TotalSurfaceArea245.46
Relative PSA0.1617
PolarSurfaceArea49.77
Druglikeness2.1796
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.69565
Fragments1
Non HAtoms23
NonCHAtoms4
Electronegative Atoms4
Rotatable Bond4
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms6
Symmetricatoms6
Amines1
Aromatic Amines1
StereoCon

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