SMILES:
O=C1CCC(NC(=O)OCC2c3ccccc3-c3ccccc32)(C(=O)O)CC1Molecular Processing
Molecular formula
C22H21NO5
Molecular weight
379.41
Exact mass
379.142
XLogP
3.49
TPSA
92.7
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
28
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.318
Molar refractivity
102.05
Supplementary Information
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