2-[(E)-4-phenoxybut-2-enyl]sulfonylnaphthalene

Formula:C20H18O3S Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(E)-4-phenoxybut-2-enyl]sulfonylnaphthalene is a drug-like molecule.

MolName	2-[(E)-4-phenoxybut-2-enyl]sulfonylnaphthalene
MolecularFormula	C20H18O3S
Smiles	O=S(C/C=C/COc1ccccc1)(c1cc2ccccc2cc1)=O
InChI	InChI=1S/C20H18O3S/c21-24(22,15-7-6-14-23-19-10-2-1-3-11-19)20-13-12-17-8-4-5-9-18(17)16-20/h1-13,16H,14-15H2
InChIK	WXOUYGYLFOIWGF-UHFFFAOYSA-N
TotalMolweight	338.426
Molweight	338.426
MonoisotopicMass	338.097665
CLogP	4.0283
CLogS	-5.133
H Acceptors	3
TotalSurfaceArea	260.22
Relative PSA	0.14826
PolarSurfaceArea	51.75
Druglikeness	-4.9221
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.66667
Fragments	1
Non HAtoms	24
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	4
Symmetricatoms	3
StereoCon

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