CCOCCNc1nccc(-c2sc(C(C)C)nc2-c2ccc(F)c(NS(=O)(=O)c3c(F)cccc3F)c2)n1
SMILES: CCOCCNc1nccc(-c2sc(C(C)C)nc2-c2ccc(F)c(NS(=O)(=O)c3c(F)cccc3F)c2)n1

Molecular Processing

Molecular formula
C26H26F3N5O3S2
Molecular weight
577.65
Exact mass
577.1429
XLogP
6.06
TPSA
106.1
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
11
Heavy atoms
39
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.269
Molar refractivity
144.77

Supplementary Information

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