Glycoside
GD034134
Name:
NoneFormula:
C18H15O4N6ClSmiles:
N#Cc1cc(-c2nn([C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)c3ncnc(N)c23)ccc1ClAglycone:
N#Cc1cc(C2=N[N]c3ncnc(N)c32)ccc1ClSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.29 |
| AlogP: | 0.21 | Num_rotatable_bonds: | 3 |
| MolWt: | 402.8 | Num_heavy_atoms: | 28 |
| TPSA: | 163.33 | NumAromaticRings: | 3 |
Unique Aglycone
AD21730
Formula: C13H6N6Cl
Smiles:
N#Cc1cc(C2=N[N]c3ncnc(N)c32)ccc1Cl| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.59 | Num_rotatable_bonds: | 1 |
| MolWt: | 269.68 | Num_heavy_atoms: | 19 |
| TPSA: | 102.05 | NumAromaticRings: | 2 |
