SMILES:
Cc1nc(-n2ccc(O)cc2=O)sc1C(=O)OMolecular Processing
Molecular formula
C10H8N2O4S
Molecular weight
252.25
Exact mass
252.0205
XLogP
1.01
TPSA
92.42
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
17
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
0.1
Molar refractivity
61.07
Supplementary Information
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