propan-2-yl (2R)-2-(4-phenylphenoxy)propanoate

Formula:C18H20O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none propan-2-yl (2R)-2-(4-phenylphenoxy)propanoate is a drug-like molecule.

MolNamepropan-2-yl (2R)-2-(4-phenylphenoxy)propanoate
MolecularFormulaC18H20O3
SmilesCC(C)OC([C@@H](C)Oc(cc1)ccc1-c1ccccc1)=O
InChIInChI=1S/C18H20O3/c1-13(2)20-18(19)14(3)21-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14H,1-3H3/t14-/m1/s1
InChIKXVNGFFLLEYHNRE-CQSZACIVSA-N
TotalMolweight284.354
Molweight284.354
MonoisotopicMass284.141245
CLogP3.9316
CLogS-4.679
H Acceptors3
TotalSurfaceArea232.55
Relative PSA0.14208
PolarSurfaceArea35.53
Druglikeness-2.6235
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.66667
Fragments1
Non HAtoms21
NonCHAtoms3
Electronegative Atoms3
StereoCenters1
Rotatable Bond6
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms7
Symmetricatoms5
StereoConthis enantiomer

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