CCN(CC)C/C=C\c1cc(F)ccc1S(=O)(=O)Cc1ccc2c(c1C(=O)O)OC[C@@H]1C[C@H]21
SMILES: CCN(CC)C/C=C\c1cc(F)ccc1S(=O)(=O)Cc1ccc2c(c1C(=O)O)OC[C@@H]1C[C@H]21

Molecular Processing

Molecular formula
C25H28FNO5S
Molecular weight
473.57
Exact mass
473.1672
XLogP
4.35
TPSA
83.91
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
33
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
123.86

Supplementary Information

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