SMILES:
CCCCc1nc2cnc3cccnc3c2n1CCOc1ccccc1Molecular Processing
Molecular formula
C21H22N4O
Molecular weight
346.43
Exact mass
346.1794
XLogP
4.4
TPSA
52.83
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
26
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
103.38
Supplementary Information
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