SMILES:
CC1CN(C(C)CN2CCC(NC(=O)c3cc4c(OCc5ccoc5)cccc4[nH]3)CC2)CCC1OMolecular Processing
Molecular formula
C28H38N4O4
Molecular weight
494.64
Exact mass
494.2893
XLogP
3.63
TPSA
93.97
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
36
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.536
Molar refractivity
139.09
Supplementary Information
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