CCC(O)(C=Cc1ccc(C(CC)(CC)c2cc(C)c(-c3ccc(CC(=O)O)c(F)c3)c(C)c2)cc1C)CC
SMILES: CCC(O)(C=Cc1ccc(C(CC)(CC)c2cc(C)c(-c3ccc(CC(=O)O)c(F)c3)c(C)c2)cc1C)CC

Molecular Processing

Molecular formula
C35H43FO3
Molecular weight
530.72
Exact mass
530.3196
XLogP
8.72
TPSA
57.53
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
11
Heavy atoms
39
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
159.76

Supplementary Information

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