(3E)-3-[[4-(naphthalen-1-ylmethoxy)phenyl]methylidene]-1H-indol-2-one

Formula:C26H19NO2 Mutagenic:low Tumorigenic:high Reproductive Effective:high (3E)-3-[[4-(naphthalen-1-ylmethoxy)phenyl]methylidene]-1H-indol-2-one is a drug-like molecule.

MolName(3E)-3-[[4-(naphthalen-1-ylmethoxy)phenyl]methylidene]-1H-indol-2-one
MolecularFormulaC26H19NO2
SmilesO=C1Nc(cccc2)c2/C1=C\c(cc1)ccc1OCc1cccc2ccccc12
InChIInChI=1S/C26H19NO2/c28-26-24(23-10-3-4-11-25(23)27-26)16-18-12-14-21(15-13-18)29-17-20-8-5-7-19-6-1-2-9-22(19)20/h1-16H,17H2,(H,27,28)
InChIKXQNHNTZOFKZFPX-UHFFFAOYSA-N
TotalMolweight377.442
Molweight377.442
MonoisotopicMass377.141579
CLogP4.8082
CLogS-6.316
H Acceptors3
H Donors1
TotalSurfaceArea291.56
Relative PSA0.11833
PolarSurfaceArea38.33
Druglikeness2.4237
Mutageniclow
Tumorigenichigh
Reproductive Effectivehigh
Irritantnone
Nasty Functions
Shape Index0.58621
Fragments1
Non HAtoms29
NonCHAtoms3
Electronegative Atoms3
Rotatable Bond4
Rings Closures5
Small Rings5
Aromatic Rings4
Aromatic Atoms22
Sp3Atoms2
Symmetricatoms2
Amides1
StereoCon

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