SMILES:
COc1ccc2c(c1)C(=O)C(Oc1ccccc1)CC2Molecular Processing
Molecular formula
C17H16O3
Molecular weight
268.31
Exact mass
268.1099
XLogP
3.27
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.235
Molar refractivity
76.5
Supplementary Information
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