(4E)-4-[(E)-3-(furan-2-yl)prop-2-enylidene]-2-[(E)-2-phenylethenyl]-1,3-oxazol-5-one

Formula:C18H13NO3 Mutagenic:none Tumorigenic:none Reproductive Effective:none (4E)-4-[(E)-3-(furan-2-yl)prop-2-enylidene]-2-[(E)-2-phenylethenyl]-1,3-oxazol-5-one is a drug-like molecule.

MolName(4E)-4-[(E)-3-(furan-2-yl)prop-2-enylidene]-2-[(E)-2-phenylethenyl]-1,3-oxazol-5-one
MolecularFormulaC18H13NO3
SmilesO=C1OC(/C=C/c2ccccc2)=N/C1=C/C=C/c1ccco1
InChIInChI=1S/C18H13NO3/c20-18-16(10-4-8-15-9-5-13-21-15)19-17(22-18)12-11-14-6-2-1-3-7-14/h1-13H
InChIKZBVYRGYHZAXHOO-UHFFFAOYSA-N
TotalMolweight291.305
Molweight291.305
MonoisotopicMass291.089544
CLogP2.7916
CLogS-4.283
H Acceptors4
TotalSurfaceArea237.64
Relative PSA0.20476
PolarSurfaceArea51.8
Druglikeness0.81412
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.68182
Fragments1
Non HAtoms22
NonCHAtoms4
Electronegative Atoms4
Rotatable Bond4
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms11
Sp3Atoms1
Symmetricatoms2
StereoCon

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