CCOP(=O)(COCCCOn1cnc2c(N)ncnc21)OCC
Name: 9-[3-(diethoxyphosphorylmethoxy)propoxy]adenine
SMILES: CCOP(=O)(COCCCOn1cnc2c(N)ncnc21)OCC

Molecular Processing

Molecular formula
C13H22N5O5P
Molecular weight
359.32
Exact mass
359.1359
XLogP
1.47
TPSA
123.61
H-bond donors
1
H-bond acceptors
9
Rotatable bonds
11
Heavy atoms
24
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.615
Molar refractivity
87.48

Supplementary Information

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