SMILES:
CCc1ccc(CCc2ccccc2OCCC2CCCCN2C(=O)OC(C)(C)C)cc1Molecular Processing
Molecular formula
C28H39NO3
Molecular weight
437.62
Exact mass
437.293
XLogP
6.59
TPSA
38.77
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
8
Heavy atoms
32
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.536
Molar refractivity
130.36
Supplementary Information
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