2-[(E)-2-(9H-fluoren-2-yl)ethenyl]-4,6-diphenylpyrylium

Formula:C32H23O Mutagenic:high Tumorigenic:high Reproductive Effective:none 2-[(E)-2-(9H-fluoren-2-yl)ethenyl]-4,6-diphenylpyrylium is not a drug-like molecule.

MolName2-[(E)-2-(9H-fluoren-2-yl)ethenyl]-4,6-diphenylpyrylium
MolecularFormulaC32H23O
SmilesC1c(cc(/C=C/c2cc(-c3ccccc3)cc(-c3ccccc3)[o+]2)cc2)c2-c2c1cccc2
InChIInChI=1S/C32H23O/c1-3-9-24(10-4-1)27-21-29(33-32(22-27)25-11-5-2-6-12-25)17-15-23-16-18-31-28(19-23)20-26-13-7-8-14-30(26)31/h1-19,21-22H,20H2/q+1
InChIKONOXIHNHDVCRLY-UHFFFAOYSA-N
TotalMolweight423.534
Molweight423.534
MonoisotopicMass423.17489
CLogP7.9881
CLogS-10.19
H Acceptors1
TotalSurfaceArea326.85
Druglikeness-5.8715
Mutagenichigh
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functionspyrylium
Shape Index0.48485
Fragments1
Non HAtoms33
NonCHAtoms1
Electronegative Atoms1
Rotatable Bond4
Rings Closures6
Small Rings6
Aromatic Rings5
Aromatic Atoms30
Sp3Atoms1
Symmetricatoms4
StereoCon

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