SMILES:
Cc1ccncc1N1CCN(c2ccc3[nH]nc(N)c3c2)C1=OMolecular Processing
Molecular formula
C16H16N6O
Molecular weight
308.35
Exact mass
308.1386
XLogP
2.3
TPSA
91.14
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
23
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.188
Molar refractivity
89.57
Supplementary Information
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