SMILES:
COc1cc(C)nc(NC(=O)NS(=O)(=O)c2ccccc2N)n1.ClMolecular Processing
Molecular formula
C13H16ClN5O4S
Molecular weight
373.82
Exact mass
373.0612
XLogP
1.31
TPSA
136.3
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
24
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
2
Fraction Csp3
0.154
Molar refractivity
90.76
Supplementary Information
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