CC(=O)Nc1nc(NC(C)=O)c2ncn(C3(C(C)=O)OC(CO)C(O)C3(OC(C)=O)C(C)=O)c2n1
SMILES: CC(=O)Nc1nc(NC(C)=O)c2ncn(C3(C(C)=O)OC(CO)C(O)C3(OC(C)=O)C(C)=O)c2n1

Molecular Processing

Molecular formula
C20H24N6O9
Molecular weight
492.45
Exact mass
492.1605
XLogP
-1.37
TPSA
211.93
H-bond donors
4
H-bond acceptors
12
Rotatable bonds
7
Heavy atoms
35
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
15
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
115.73

Supplementary Information

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