SMILES:
CC1(c2csc(Cn3ncc([N+](=O)[O-])n3)n2)OCCO1Molecular Processing
Molecular formula
C10H11N5O4S
Molecular weight
297.3
Exact mass
297.0532
XLogP
0.91
TPSA
105.2
H-bond donors
0
H-bond acceptors
8
Rotatable bonds
4
Heavy atoms
20
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
0.5
Molar refractivity
67.15
Supplementary Information
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