SMILES:
N#Cc1c(N)cc(N)nc1Oc1ccccc1Molecular Processing
Molecular formula
C12H10N4O
Molecular weight
226.24
Exact mass
226.0855
XLogP
1.91
TPSA
97.95
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
64.29
Supplementary Information
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