SMILES:
CNC(=N[N+](=O)[O-])NCCSCc1ccsn1Molecular Processing
Molecular formula
C8H13N5O2S2
Molecular weight
275.36
Exact mass
275.0511
XLogP
0.73
TPSA
92.45
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
69.77
Supplementary Information
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