SMILES:
COc1nc(N)nc2nc[nH]c12Molecular Processing
Molecular formula
C6H7N5O
Molecular weight
165.16
Exact mass
165.0651
XLogP
-0.06
TPSA
89.71
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
1
Heavy atoms
12
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
42.65
Supplementary Information
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