SMILES:
NC(=O)c1cc(-c2ccc(N3CCS(=O)(=O)CC3)cc2)sc1[N+](=O)[O-]Molecular Processing
Molecular formula
C15H15N3O5S2
Molecular weight
381.44
Exact mass
381.0453
XLogP
1.66
TPSA
123.61
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
25
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.267
Molar refractivity
95.79
Supplementary Information
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