SMILES:
CCCOc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1OMolecular Processing
Molecular formula
C13H18N4O5
Molecular weight
310.31
Exact mass
310.1277
XLogP
-0.77
TPSA
122.75
H-bond donors
3
H-bond acceptors
8
Rotatable bonds
5
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
4
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.615
Molar refractivity
74.12
Supplementary Information
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