SMILES:
O=C(O)Cn1nnnc1-c1ccsc1Molecular Processing
Molecular formula
C7H6N4O2S
Molecular weight
210.22
Exact mass
210.0211
XLogP
0.49
TPSA
80.9
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
14
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
0.143
Molar refractivity
48.77
Supplementary Information
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