Название: Compound 4
SMILES:
CCOC1=CC(=O)C(CCCOC(=O)c2ccccc2NC)CC1Molecular Processing
Molecular formula
C19H25NO4
Molecular weight
331.41
Exact mass
331.1784
XLogP
3.56
TPSA
64.63
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
24
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.474
Molar refractivity
92.95
Supplementary Information
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