Glycoside
GD085750
Name:
NoneFormula:
C17H14O4N6Cl2Smiles:
OC[C@H]1O[C@@H](n2cnc3c(Nc4ccnc(Cl)c4Cl)ncnc32)[C@@H](O)[C@@H]1OAglycone:
Clc1nccc(Nc2ncnc3c2N=C[N]3)c1ClSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 0.88 | Num_rotatable_bonds: | 4 |
| MolWt: | 413.22 | Num_heavy_atoms: | 27 |
| TPSA: | 138.44 | NumAromaticRings: | 3 |
Unique Aglycone
AD38171
Formula: C12H5N6Cl2
Smiles:
Clc1nccc(Nc2ncnc3c2N=C[N]3)c1Cl| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 2.83 | Num_rotatable_bonds: | 2 |
| MolWt: | 280.1 | Num_heavy_atoms: | 18 |
| TPSA: | 77.16 | NumAromaticRings: | 2 |
