SMILES:
NCCC[C@H](NC(=O)c1ccc(CNC(=O)OCc2ccccc2)cc1)C(=O)OMolecular Processing
Molecular formula
C21H25N3O5
Molecular weight
399.45
Exact mass
399.1794
XLogP
2.03
TPSA
130.75
H-bond donors
4
H-bond acceptors
5
Rotatable bonds
10
Heavy atoms
29
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
107.09
Supplementary Information
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