SMILES:
CCOCCOCCOc1nc(Nc2cc[nH]n2)cc2ccccc12Molecular Processing
Molecular formula
C18H22N4O3
Molecular weight
342.4
Exact mass
342.1692
XLogP
3.13
TPSA
81.29
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
25
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
96.42
Supplementary Information
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