SMILES:
Cc1c(C#N)ccc2nc(N)nc(N)c12Molecular Processing
Molecular formula
C10H9N5
Molecular weight
199.22
Exact mass
199.0858
XLogP
0.97
TPSA
101.61
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
0
Heavy atoms
15
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
0.1
Molar refractivity
57.81
Supplementary Information
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