COc1cc(OC)nc(NC(=O)NS(=O)(=O)c2ccccc2CN2CN=CN2)n1
SMILES: COc1cc(OC)nc(NC(=O)NS(=O)(=O)c2ccccc2CN2CN=CN2)n1

Molecular Processing

Molecular formula
C16H19N7O5S
Molecular weight
421.44
Exact mass
421.1168
XLogP
0.31
TPSA
147.14
H-bond donors
3
H-bond acceptors
10
Rotatable bonds
7
Heavy atoms
29
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
102.96

Supplementary Information

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