SMILES:
CC(=O)NCC1CN(c2ccc(B3OC(C)(C)C(C)(C)O3)c(F)c2)C(=O)O1Molecular Processing
Molecular formula
C18H24BFN2O5
Molecular weight
378.21
Exact mass
378.1762
XLogP
1.59
TPSA
77.1
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
27
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
98.41
Supplementary Information
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