SMILES:
C=C(C)C1CCC(Oc2ncnc3ccccc23)CC1Molecular Processing
Molecular formula
C17H20N2O
Molecular weight
268.36
Exact mass
268.1576
XLogP
4.14
TPSA
35.01
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
80.73
Supplementary Information
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