SMILES:
CC(c1ccccc1)N1CCC(C(=O)OCc2ccccc2)C1CMolecular Processing
Molecular formula
C21H25NO2
Molecular weight
323.44
Exact mass
323.1885
XLogP
4.2
TPSA
29.54
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
24
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.381
Molar refractivity
95.37
Supplementary Information
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