CO[C@@H]1CN(c2ccc(-c3ccc(C4(O)CN5CCC4CC5)cc3)c(Cc3ccccc3)n2)C[C@H]1O
SMILES: CO[C@@H]1CN(c2ccc(-c3ccc(C4(O)CN5CCC4CC5)cc3)c(Cc3ccccc3)n2)C[C@H]1O

Molecular Processing

Molecular formula
C30H35N3O3
Molecular weight
485.63
Exact mass
485.2678
XLogP
3.45
TPSA
69.06
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
36
Rings
7
Aromatic rings
3
Saturated rings
4
Aliphatic rings
4
Stereo centers
3
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.433
Molar refractivity
141

Supplementary Information

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