4-[(2R)-2-(4-hydroxyphenoxy)-2-sulfanylethoxy]phenol

Formula:C14H14O4S Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-[(2R)-2-(4-hydroxyphenoxy)-2-sulfanylethoxy]phenol is a drug-like molecule.

MolName4-[(2R)-2-(4-hydroxyphenoxy)-2-sulfanylethoxy]phenol
MolecularFormulaC14H14O4S
SmilesOc(cc1)ccc1OC[C@H](Oc(cc1)ccc1O)S
InChIInChI=1S/C14H14O4S/c15-10-1-5-12(6-2-10)17-9-14(19)18-13-7-3-11(16)4-8-13/h1-8,14-16,19H,9H2/t14-/m1/s1
InChIKZEDDKYPUKGEUOJ-CQSZACIVSA-N
TotalMolweight278.327
Molweight278.327
MonoisotopicMass278.06128
CLogP2.3218
CLogS-3.087
H Acceptors4
H Donors2
TotalSurfaceArea207.84
Relative PSA0.33107
PolarSurfaceArea97.72
Druglikeness-5.3049
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.73684
Fragments1
Non HAtoms19
NonCHAtoms5
Electronegative Atoms5
StereoCenters1
Rotatable Bond5
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms7
Symmetricatoms4
StereoConthis enantiomer

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