SMILES:
COC(=O)Cc1ccc(C(NC(=O)CCC(N)(Cc2ccccc2)C(=O)O)C(=O)OC)cc1Molecular Processing
Molecular formula
C24H28N2O7
Molecular weight
456.5
Exact mass
456.1897
XLogP
1.54
TPSA
145.02
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
11
Heavy atoms
33
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
119
Supplementary Information
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