SMILES:
CC1C(=O)N(C(CO)CCN2CCC3(CC3)C(O)C2)CCN1C(=O)OCc1ccccc1Molecular Processing
Molecular formula
C24H35N3O5
Molecular weight
445.56
Exact mass
445.2577
XLogP
1.45
TPSA
93.55
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
32
Rings
4
Aromatic rings
1
Saturated rings
3
Aliphatic rings
3
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
118.73
Supplementary Information
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