Glycoside
GD061871
Name:
NoneFormula:
C14H16O5N3ClSmiles:
N#CCc1cnc(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c(Cl)c1Aglycone:
N#CCc1cnc(N)c(Cl)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | -0.99 | Num_rotatable_bonds: | 4 |
| MolWt: | 329.74 | Num_heavy_atoms: | 22 |
| TPSA: | 138.86 | NumAromaticRings: | 1 |
Unique Aglycone
AD30251
Formula: C8H6N3Cl
Smiles:
N#CCc1cnc(N)c(Cl)c1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 1.38 | Num_rotatable_bonds: | 1 |
| MolWt: | 167.6 | Num_heavy_atoms: | 11 |
| TPSA: | 62.7 | NumAromaticRings: | 1 |
