SMILES:
NCCCCC[C@H](N[C@H]1COc2ccccc2N(CC(=O)O)C1=O)C(=O)OMolecular Processing
Molecular formula
C18H25N3O6
Molecular weight
379.41
Exact mass
379.1743
XLogP
0.43
TPSA
142.19
H-bond donors
4
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
27
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
97.8
Supplementary Information
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