SMILES:
COc1cccc(C2CCc3cc(O)ccc3O2)c1Molecular Processing
Molecular formula
C16H16O3
Molecular weight
256.3
Exact mass
256.1099
XLogP
3.47
TPSA
38.69
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
19
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
0.25
Molar refractivity
72.79
Supplementary Information
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