SMILES:
COC(=O)C1CC(=O)CCN1[C@@H](C)c1ccccc1Molecular Processing
Molecular formula
C15H19NO3
Molecular weight
261.32
Exact mass
261.1365
XLogP
1.95
TPSA
46.61
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
19
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
0.467
Molar refractivity
71.61
Supplementary Information
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