OCCn1c(-c2ccccc2)nc2cc(CN3CCN(C(c4ccccc4)c4ccccc4)CC3)ccc21
SMILES: OCCn1c(-c2ccccc2)nc2cc(CN3CCN(C(c4ccccc4)c4ccccc4)CC3)ccc21

Molecular Processing

Molecular formula
C33H34N4O
Molecular weight
502.66
Exact mass
502.2733
XLogP
5.6
TPSA
44.53
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
38
Rings
6
Aromatic rings
5
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.242
Molar refractivity
153.83

Supplementary Information

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