SMILES:
CCOC(=O)CCC(=O)CC(=O)Nc1cccc2cc3cccc4c3c(c12)C(=O)N(CCN(C)C)C4=OMolecular Processing
Molecular formula
C28H29N3O6
Molecular weight
503.56
Exact mass
503.2056
XLogP
3.39
TPSA
113.09
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
10
Heavy atoms
37
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.321
Molar refractivity
139.5
Supplementary Information
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