Glycoside
GD099040
Name:
NoneFormula:
C16H18O4N6ISmiles:
Cc1cc(Nc2nc(I)nc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc[nH+]1Aglycone:
Cc1cc(Nc2nc(I)nc3c2N=C[N]3)cc[nH+]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -0.09 | Num_rotatable_bonds: | 4 |
| MolWt: | 485.26 | Num_heavy_atoms: | 27 |
| TPSA: | 139.69 | NumAromaticRings: | 3 |
Unique Aglycone
AD42158
Formula: C11H9N6I
Smiles:
Cc1cc(Nc2nc(I)nc3c2N=C[N]3)cc[nH+]1| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.09 |
| AlogP: | 1.86 | Num_rotatable_bonds: | 2 |
| MolWt: | 352.14 | Num_heavy_atoms: | 18 |
| TPSA: | 78.41 | NumAromaticRings: | 2 |
