SMILES:
COc1ccc(F)c(-c2ccc(OCc3cccc(C(CC(=O)[O-])C4CC4)c3)cc2CC(C)(C)C)c1.[Na+]Molecular Processing
Molecular formula
C31H34FNaO4
Molecular weight
512.6
Exact mass
512.2339
XLogP
3.31
TPSA
58.59
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
10
Heavy atoms
37
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
2
Fraction Csp3
0.387
Molar refractivity
137.41
Supplementary Information
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