SMILES:
CCCCCCOC(=O)C(O)[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OMolecular Processing
Molecular formula
C17H25N5O6
Molecular weight
395.42
Exact mass
395.1805
XLogP
-0.49
TPSA
165.84
H-bond donors
4
H-bond acceptors
10
Rotatable bonds
8
Heavy atoms
28
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
5
Undefined stereo
1
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.647
Molar refractivity
96.77
Supplementary Information
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