SMILES:
CCCN(CCC)C(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)[C@H](O)CNCc2cccc(OC)c2)cc(-c2ccc(OC)cc2)c1.ClMolecular Processing
Molecular formula
C39H48ClN3O5
Molecular weight
674.28
Exact mass
673.3282
XLogP
6.55
TPSA
100.13
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
17
Heavy atoms
48
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
2
Fraction Csp3
0.333
Molar refractivity
194.27
Supplementary Information
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