SMILES:
CC[C@H]1C2C[C@H]3[C@@H]4N(C)c5ccccc5C45C[C@@H](C2[C@H]5O)[N+]3([O-])[C@@H]1OMolecular Processing
Molecular formula
C20H26N2O3
Molecular weight
342.44
Exact mass
342.1943
XLogP
1.57
TPSA
66.76
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
25
Rings
7
Aromatic rings
1
Saturated rings
5
Aliphatic rings
6
Stereo centers
10
Undefined stereo
4
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.7
Molar refractivity
93.52
Supplementary Information
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