SMILES:
CC1(C)CCC(N(C(=O)C(C)(C)CO)C2CCN(C(=O)OC(C)(C)C)C2)CC1Molecular Processing
Molecular formula
C22H40N2O4
Molecular weight
396.57
Exact mass
396.2988
XLogP
3.81
TPSA
70.08
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
28
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.909
Molar refractivity
109.96
Supplementary Information
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