Name: 3-(3-((((3aR,4R,6R,6aR)-6-(6-amino-9H-purin-9-yl)-2,2-dimethyltetrahydrofuro[3,4-d][1,3]dioxol-4-yl)methyl)(methyl)amino)cyclobutyl)propanoic acid
SMILES:
CN(C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@@H]2OC(C)(C)O[C@@H]21)C1CC(CCC(=O)O)C1Molecular Processing
Molecular formula
C21H30N6O5
Molecular weight
446.51
Exact mass
446.2278
XLogP
1.4
TPSA
137.85
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
7
Heavy atoms
32
Rings
5
Aromatic rings
2
Saturated rings
3
Aliphatic rings
3
Stereo centers
4
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.714
Molar refractivity
113.48
Supplementary Information
Details werden geladen…
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