SMILES:
CNc1ncc2cc(B3OC(C)(C)C(C)(C)O3)ccc2n1Molecular Processing
Molecular formula
C15H20BN3O2
Molecular weight
285.16
Exact mass
285.1649
XLogP
1.97
TPSA
56.27
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.467
Molar refractivity
84.8
Supplementary Information
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