(E)-1-morpholin-4-yl-3-phenyl-2-pyridin-4-ylprop-2-en-1-one
Molecular Formula : C18H18N2O2 | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |(E)-1-morpholin-4-yl-3-phenyl-2-pyridin-4-ylprop-2-en-1-one is a drug-like molecule.
MolName : (E)-1-morpholin-4-yl-3-phenyl-2-pyridin-4-ylprop-2-en-1-one |
MolecularFormula : C18H18N2O2 |
Smiles : O=C(/C(/c1ccncc1)=C/c1ccccc1)N1CCOCC1 |
InChI : InChI=1S/C18H18N2O2/c21-18(20-10-12-22-13-11-20)17(16-6-8-19-9-7-16)14-15-4-2-1-3-5-15/h1-9,14H,10-13H2 |
InChIK : JZCAPRYWVLWDHZ-UHFFFAOYSA-N |
TotalMolweight : 294.353 |
Molweight : 294.353 |
MonoisotopicMass : 294.136828 |
CLogP : 1.999 |
CLogS : -1.858 |
H Acceptors : 4 |
TotalSurfaceArea : 236.08 |
Relative PSA : 0.1591 |
PolarSurfaceArea : 42.43 |
Druglikeness : 3.8776 |
Mutagenic : none |
Tumorigenic : none |
Reproductive Effective : none |
Irritant : none |
Nasty Functions : |
Shape Index : 0.5 |
Fragments : 1 |
Non HAtoms : 22 |
NonCHAtoms : 4 |
Electronegative Atoms : 4 |
Rotatable Bond : 3 |
Rings Closures : 3 |
Small Rings : 3 |
Aromatic Rings : 2 |
Aromatic Atoms : 12 |
Sp3Atoms : 5 |
Symmetricatoms : 6 |
Amides : 1 |
Aromatic Nitrogens : 1 |
StereoCon : |