SMILES:
C=CC[C@@H](NC(=O)OCc1ccccc1)[C@H](O)c1ccccc1Molecular Processing
Molecular formula
C19H21NO3
Molecular weight
311.38
Exact mass
311.1521
XLogP
3.59
TPSA
58.56
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
7
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.211
Molar refractivity
89.77
Supplementary Information
Récupération des détails…
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