SMILES:
COc1cc(OC)nc(NC(=O)NS(=O)(=O)Nc2ccccc2C(O)C2CC2)n1Molecular Processing
Molecular formula
C17H21N5O6S
Molecular weight
423.45
Exact mass
423.1213
XLogP
1.42
TPSA
151.77
H-bond donors
4
H-bond acceptors
8
Rotatable bonds
8
Heavy atoms
29
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.353
Molar refractivity
103.96
Supplementary Information
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