Glycoside
GD088524
Name:
NoneFormula:
C13H14O6N2ClISmiles:
O=C(N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1cnc(Cl)c(I)c1Aglycone:
NC(=O)c1cnc(Cl)c(I)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.13 | Num_rotatable_bonds: | 3 |
| MolWt: | 444.61 | Num_heavy_atoms: | 22 |
| TPSA: | 132.14 | NumAromaticRings: | 1 |
Unique Aglycone
AD38726
Formula: C7H4ON2ClI
Smiles:
NC(=O)c1cnc(Cl)c(I)c1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.44 | Num_rotatable_bonds: | 1 |
| MolWt: | 282.47 | Num_heavy_atoms: | 11 |
| TPSA: | 55.98 | NumAromaticRings: | 1 |
