CCOC(=O)N1CCC(O)(c2cc(F)cc(Sc3ccc(C4(C)OCCO4)cc3)c2)C1
SMILES: CCOC(=O)N1CCC(O)(c2cc(F)cc(Sc3ccc(C4(C)OCCO4)cc3)c2)C1

Molecular Processing

Molecular formula
C23H26FNO5S
Molecular weight
447.53
Exact mass
447.1516
XLogP
4.25
TPSA
68.23
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
31
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.435
Molar refractivity
113.33

Supplementary Information

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