SMILES:
NS(=O)(=O)Oc1cccc(-n2ccnc2)c1Molecular Processing
Molecular formula
C9H9N3O3S
Molecular weight
239.26
Exact mass
239.0365
XLogP
0.45
TPSA
87.21
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0
Molar refractivity
57.3
Supplementary Information
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