الاسم: Compound 27
SMILES:
CC(=O)Nc1nc(OC(C)C)c2sc(=O)n([C@@H]3O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H]3OC(C)=O)c2n1Molecular Processing
Molecular formula
C21H26N4O10S
Molecular weight
526.52
Exact mass
526.137
XLogP
0.92
TPSA
174.24
H-bond donors
1
H-bond acceptors
13
Rotatable bonds
8
Heavy atoms
36
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
4
Undefined stereo
0
Formal charge
0
Heteroatoms
15
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
123.39
Supplementary Information
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