SMILES:
CC12CCC(OCCNCCN3CCCC3)CC1CCC1C2CCC2(C)C(c3ccoc3)CCC12OMolecular Processing
Molecular formula
C31H50N2O3
Molecular weight
498.75
Exact mass
498.3821
XLogP
5.59
TPSA
57.87
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
36
Rings
6
Aromatic rings
1
Saturated rings
5
Aliphatic rings
5
Stereo centers
8
Undefined stereo
8
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.871
Molar refractivity
142.92
Supplementary Information
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