SMILES:
CC(C)(C)c1cc(Nc2cccc(OCC(=O)O)c2)cc(C(C)(C)C)c1OMolecular Processing
Molecular formula
C22H29NO4
Molecular weight
371.48
Exact mass
371.2097
XLogP
5.19
TPSA
78.79
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
27
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.409
Molar refractivity
108.36
Supplementary Information
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