Nc1ccn(C2OC(CO)C(O)N(c3ncccn3)C2O)c(=O)n1
SMILES: Nc1ccn(C2OC(CO)C(O)N(c3ncccn3)C2O)c(=O)n1

Molecular Processing

Molecular formula
C13H16N6O5
Molecular weight
336.31
Exact mass
336.1182
XLogP
-2.35
TPSA
159.85
H-bond donors
4
H-bond acceptors
10
Rotatable bonds
3
Heavy atoms
24
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
80.43

Supplementary Information

Récupération des détails…

Impliqué dans 1 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→