SMILES:
COC(OC)c1cnc(N)c(C#N)n1Molecular Processing
Molecular formula
C8H10N4O2
Molecular weight
194.19
Exact mass
194.0804
XLogP
0.22
TPSA
94.05
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
47.92
Supplementary Information
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