SMILES:
CC(C)COC(=O)NC1CCN(CC(O)COc2ccc(O)c3c2CCC(=O)N3)CC1Molecular Processing
Molecular formula
C22H33N3O6
Molecular weight
435.52
Exact mass
435.2369
XLogP
1.86
TPSA
120.36
H-bond donors
4
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
31
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.636
Molar refractivity
115.34
Supplementary Information
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