Glycoside
GD017878
Name:
NoneFormula:
C20H20O4N4Cl2Smiles:
CC(C)Nc1nc2nc3cc(Cl)c(Cl)cc3cc2n1C1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CC(C)NC1=Nc2nc3cc(Cl)c(Cl)cc3cc2[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.44 |
| AlogP: | 2.32 | Num_rotatable_bonds: | 4 |
| MolWt: | 427.29 | Num_heavy_atoms: | 28 |
| TPSA: | 112.66 | NumAromaticRings: | 3 |
Unique Aglycone
AD12707
Formula: C15H11N4Cl2
Smiles:
CC(C)NC1=Nc2nc3cc(Cl)c(Cl)cc3cc2[N]1| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.23 |
| AlogP: | 3.78 | Num_rotatable_bonds: | 1 |
| MolWt: | 294.17 | Num_heavy_atoms: | 19 |
| TPSA: | 51.38 | NumAromaticRings: | 2 |
