SMILES:
COc1ccc2c3c1O[C@H]1C(=O)CC[C@H]4[C@@H](C2)N(C)CC[C@]314.C[C@H](N)C(=O)N1CCC[C@H]1C(=O)OMolecular Processing
Molecular formula
C26H35N3O6
Molecular weight
485.58
Exact mass
485.2526
XLogP
1.34
TPSA
122.4
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
3
Heavy atoms
35
Rings
6
Aromatic rings
1
Saturated rings
3
Aliphatic rings
5
Stereo centers
6
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
2
Fraction Csp3
0.654
Molar refractivity
127.58
Supplementary Information
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