4-[4-[5-[(E)-2-phenylethenyl]-1,3,4-oxadiazol-2-yl]phenyl]morpholine

Formula:C20H19N3O2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-[4-[5-[(E)-2-phenylethenyl]-1,3,4-oxadiazol-2-yl]phenyl]morpholine is a drug-like molecule.

MolName4-[4-[5-[(E)-2-phenylethenyl]-1,3,4-oxadiazol-2-yl]phenyl]morpholine
MolecularFormulaC20H19N3O2
SmilesC(COCC1)N1c(cc1)ccc1-c1nnc(/C=C/c2ccccc2)o1
InChIInChI=1S/C20H19N3O2/c1-2-4-16(5-3-1)6-11-19-21-22-20(25-19)17-7-9-18(10-8-17)23-12-14-24-15-13-23/h1-11H,12-15H2
InChIKGMXBDBJJANZADX-UHFFFAOYSA-N
TotalMolweight333.39
Molweight333.39
MonoisotopicMass333.147727
CLogP3.2502
CLogS-4.868
H Acceptors5
TotalSurfaceArea268.33
Relative PSA0.18485
PolarSurfaceArea51.39
Druglikeness2.2266
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.68
Fragments1
Non HAtoms25
NonCHAtoms5
Electronegative Atoms5
Rotatable Bond4
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms17
Sp3Atoms5
Symmetricatoms6
Amines1
Aromatic Amines1
Aromatic Nitrogens2
StereoCon

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