Название: (3R)-3-amino-6-(4-hydroxyphenyl)azepan-2-one
SMILES:
N[C@@H]1CCC(c2ccc(O)cc2)CNC1=OMolecular Processing
Molecular formula
C12H16N2O2
Molecular weight
220.27
Exact mass
220.1212
XLogP
0.71
TPSA
75.35
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
61.07
Supplementary Information
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