SMILES:
COc1ccc(CN2CCN(Cc3ccc(N)cn3)CC2(C)C)cc1Molecular Processing
Molecular formula
C20H28N4O
Molecular weight
340.47
Exact mass
340.2263
XLogP
2.77
TPSA
54.62
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
25
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.45
Molar refractivity
101.41
Supplementary Information
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