CN1CCN(C(CN2CCN(C(=O)CCCc3cccc4ccccc34)CC2)c2ccc(F)cc2)CC1
SMILES: CN1CCN(C(CN2CCN(C(=O)CCCc3cccc4ccccc34)CC2)c2ccc(F)cc2)CC1

Molecular Processing

Molecular formula
C31H39FN4O
Molecular weight
502.68
Exact mass
502.3108
XLogP
4.43
TPSA
30.03
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
37
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.452
Molar refractivity
148.12

Supplementary Information

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