Glycoside
GD101259
Name:
NoneFormula:
C14H15O4N6ISmiles:
OC[C@H]1O[C@@H](n2cc(I)c3c(Nc4cn[nH]c4)ncnc32)[C@H](O)[C@@H]1OAglycone:
IC1=C[N]c2ncnc(Nc3cn[nH]c3)c21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.36 |
| AlogP: | 0.11 | Num_rotatable_bonds: | 4 |
| MolWt: | 458.22 | Num_heavy_atoms: | 25 |
| TPSA: | 141.34 | NumAromaticRings: | 3 |
Unique Aglycone
AD42832
Formula: C9H6N6I
Smiles:
IC1=C[N]c2ncnc(Nc3cn[nH]c3)c21| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.93 | Num_rotatable_bonds: | 2 |
| MolWt: | 325.09 | Num_heavy_atoms: | 16 |
| TPSA: | 80.59 | NumAromaticRings: | 2 |
