SMILES:
Nc1csc2ccc([N+](=O)[O-])cc12Molecular Processing
Molecular formula
C8H6N2O2S
Molecular weight
194.21
Exact mass
194.015
XLogP
2.39
TPSA
69.16
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
13
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
Molar refractivity
52.89
Supplementary Information
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