SMILES:
CN(CCCSCCCC(F)(F)C(F)(F)F)CCc1ccc(C2CC3(C)C(O)CCC3C3CCc4cc(O)ccc4C23)cc1Molecular Processing
Molecular formula
C35H46F5NO2S
Molecular weight
639.82
Exact mass
639.3169
XLogP
8.58
TPSA
43.7
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
12
Heavy atoms
44
Rings
5
Aromatic rings
2
Saturated rings
2
Aliphatic rings
3
Stereo centers
6
Undefined stereo
6
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.657
Molar refractivity
166.68
Supplementary Information
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