SMILES:
CNC(N)=NC(=O)c1cc2ccccc2[nH]1Molecular Processing
Molecular formula
C11H12N4O
Molecular weight
216.24
Exact mass
216.1011
XLogP
0.84
TPSA
83.27
H-bond donors
3
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
16
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
0.091
Molar refractivity
63.31
Supplementary Information
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