SMILES:
COc1ccc(Cc2cnc(N)nc2N)cc1OMolecular Processing
Molecular formula
C12H14N4O2
Molecular weight
246.27
Exact mass
246.1117
XLogP
0.95
TPSA
107.28
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
68.32
Supplementary Information
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