SMILES:
NC1CCCCC1N1C[C@H](CCCB(O)O)[C@](N)(C(=O)O)C1Molecular Processing
Molecular formula
C14H28BN3O4
Molecular weight
313.21
Exact mass
313.2173
XLogP
-0.78
TPSA
133.04
H-bond donors
5
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
22
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
4
Undefined stereo
2
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.929
Molar refractivity
84.08
Supplementary Information
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