Glycoside
GD101321
Name:
NoneFormula:
C17H19O4N6ISmiles:
Cc1ccc(Nc2nc(I)nc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1NAglycone:
Cc1ccc(Nc2nc(I)nc3c2N=C[N]3)cc1NSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.35 |
| AlogP: | 0.68 | Num_rotatable_bonds: | 4 |
| MolWt: | 498.28 | Num_heavy_atoms: | 28 |
| TPSA: | 151.57 | NumAromaticRings: | 3 |
Unique Aglycone
AD42876
Formula: C12H10N6I
Smiles:
Cc1ccc(Nc2nc(I)nc3c2N=C[N]3)cc1N| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.08 |
| AlogP: | 2.62 | Num_rotatable_bonds: | 2 |
| MolWt: | 365.16 | Num_heavy_atoms: | 19 |
| TPSA: | 90.29 | NumAromaticRings: | 2 |
