SMILES:
CC(C)(Cc1ccccc1)OC(=O)C[C@H]1C[C@@H](CSc2nnnn2-c2ccccc2)OC(C)(C)O1Molecular Processing
Molecular formula
C26H32N4O4S
Molecular weight
496.63
Exact mass
496.2144
XLogP
4.62
TPSA
88.36
H-bond donors
0
H-bond acceptors
8
Rotatable bonds
9
Heavy atoms
35
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
133.25
Supplementary Information
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