SMILES:
CCOC(=O)Cc1cc(N)ccc1S(=O)(=O)Nc1cc2c(cc1F)COB2OMolecular Processing
Molecular formula
C17H18BFN2O6S
Molecular weight
408.22
Exact mass
408.0963
XLogP
0.53
TPSA
127.95
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
28
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.235
Molar refractivity
100.8
Supplementary Information
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