SMILES:
COC(=O)NC(=S)Nc1ccc(SCSC)cc1[N+](=O)[O-]Molecular Processing
Molecular formula
C11H13N3O4S3
Molecular weight
347.44
Exact mass
347.0068
XLogP
3.06
TPSA
93.5
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
21
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
89.1
Supplementary Information
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