(4Z)-4-[[2-[(2-chlorophenyl)methoxy]naphthalen-1-yl]methylidene]-2-phenyl-1,3-oxazol-5-one

Formula:C27H18NO3Cl Mutagenic:high Tumorigenic:high Reproductive Effective:none (4Z)-4-[[2-[(2-chlorophenyl)methoxy]naphthalen-1-yl]methylidene]-2-phenyl-1,3-oxazol-5-one is not a drug-like molecule.

MolName(4Z)-4-[[2-[(2-chlorophenyl)methoxy]naphthalen-1-yl]methylidene]-2-phenyl-1,3-oxazol-5-one
MolecularFormulaC27H18NO3Cl
SmilesO=C1OC(c2ccccc2)=N/C1=C\c(c1ccccc1cc1)c1OCc(cccc1)c1Cl
InChIInChI=1S/C27H18ClNO3/c28-23-13-7-5-11-20(23)17-31-25-15-14-18-8-4-6-12-21(18)22(25)16-24-27(30)32-26(29-24)19-9-2-1-3-10-19/h1-16H,17H2
InChIKAOUDVVZZVHQORK-UHFFFAOYSA-N
TotalMolweight439.897
Molweight439.897
MonoisotopicMass439.097521
CLogP5.7403
CLogS-7.602
H Acceptors4
TotalSurfaceArea328.49
Relative PSA0.13562
PolarSurfaceArea47.89
Druglikeness0.80549
Mutagenichigh
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.5
Fragments1
Non HAtoms32
NonCHAtoms5
Electronegative Atoms5
Rotatable Bond5
Rings Closures5
Small Rings5
Aromatic Rings4
Aromatic Atoms22
Sp3Atoms3
Symmetricatoms2
StereoCon

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