SMILES:
CS(=O)(=O)NC1CC(n2cnc3c(N)nc(Cl)nc32)C(O)C1OMolecular Processing
Molecular formula
C11H15ClN6O4S
Molecular weight
362.8
Exact mass
362.0564
XLogP
-1.35
TPSA
156.25
H-bond donors
4
H-bond acceptors
8
Rotatable bonds
3
Heavy atoms
23
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.545
Molar refractivity
82.18
Supplementary Information
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