SMILES:
CCC(c1ccccc1)C1c2cc(OC)c(OC)cc2CCN1CC(=O)NCc1ccccn1Molecular Processing
Molecular formula
C28H33N3O3
Molecular weight
459.59
Exact mass
459.2522
XLogP
4.51
TPSA
63.69
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
34
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.357
Molar refractivity
133.12
Supplementary Information
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