SMILES:
CCOC(=O)Nc1ccc2c(c1)OCC1(CO2)CN(C(C)C)C(=O)O1Molecular Processing
Molecular formula
C17H22N2O6
Molecular weight
350.37
Exact mass
350.1478
XLogP
2.63
TPSA
86.33
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
25
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.529
Molar refractivity
89.13
Supplementary Information
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