Glycoside
GD006607
Name:
NoneFormula:
C21H21O4N8ClSmiles:
CNc1nc(-c2cn(Cc3cccc(Cl)c3)nn2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CNc1nc(-c2cn(Cc3cccc(Cl)c3)nn2)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.35 |
| AlogP: | 0.44 | Num_rotatable_bonds: | 6 |
| MolWt: | 472.89 | Num_heavy_atoms: | 33 |
| TPSA: | 156.26 | NumAromaticRings: | 4 |
Unique Aglycone
AD05454
Formula: C16H12N8Cl
Smiles:
CNc1nc(-c2cn(Cc3cccc(Cl)c3)nn2)nc2c1N=C[N]2| HBA: | 8 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.13 |
| AlogP: | 2.39 | Num_rotatable_bonds: | 4 |
| MolWt: | 339.77 | Num_heavy_atoms: | 24 |
| TPSA: | 94.98 | NumAromaticRings: | 3 |
