Название: resultant compound
SMILES:
Cc1cccc(COC(=O)N[C@H](C(=O)O)C(C)C)n1Molecular Processing
Molecular formula
C13H18N2O4
Molecular weight
266.3
Exact mass
266.1267
XLogP
1.73
TPSA
88.52
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
19
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
68.56
Supplementary Information
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