SMILES:
COc1cc2c(cc1OC)CC(N(Cc1ccccc1)CC(O)COc1ccccc1)CCC2Molecular Processing
Molecular formula
C29H35NO4
Molecular weight
461.6
Exact mass
461.2566
XLogP
4.89
TPSA
51.16
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
10
Heavy atoms
34
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.379
Molar refractivity
134.77
Supplementary Information
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