SMILES:
Cn1cc(B(O)O)cn1Molecular Processing
Molecular formula
C4H7BN2O2
Molecular weight
125.92
Exact mass
126.0601
XLogP
-1.9
TPSA
58.28
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
9
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
33.03
Supplementary Information
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