CCC(CC)(c1ccc(OCC(=O)C(C)(C)C)c(C)c1)c1ccc(-c2ccc(CC(=O)O)c(F)c2)c(C)c1
SMILES: CCC(CC)(c1ccc(OCC(=O)C(C)(C)C)c(C)c1)c1ccc(-c2ccc(CC(=O)O)c(F)c2)c(C)c1

Molecular Processing

Molecular formula
C33H39FO4
Molecular weight
518.67
Exact mass
518.2832
XLogP
7.84
TPSA
63.6
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
10
Heavy atoms
38
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.394
Molar refractivity
150.41

Supplementary Information

Details werden geladen…

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