SMILES:
CCCC(=O)Nc1n[nH]c2ncc(-c3ccccc3)cc12Molecular Processing
Molecular formula
C16H16N4O
Molecular weight
280.33
Exact mass
280.1324
XLogP
3.36
TPSA
70.67
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
21
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.188
Molar refractivity
82.86
Supplementary Information
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