Glycoside
GD025328
Name:
NoneFormula:
C14H13O4N3Cl2Smiles:
Nc1nc2cc(Cl)c(Cl)cc2n1C1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
NC1=Nc2cc(Cl)c(Cl)cc2[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | 0.54 | Num_rotatable_bonds: | 2 |
| MolWt: | 334.16 | Num_heavy_atoms: | 21 |
| TPSA: | 113.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD16808
Formula: C9H4N3Cl2
Smiles:
NC1=Nc2cc(Cl)c(Cl)cc2[N]1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.19 | Num_rotatable_bonds: | 0 |
| MolWt: | 201.04 | Num_heavy_atoms: | 12 |
| TPSA: | 52.48 | NumAromaticRings: | 1 |
