Glycoside
GD035932
Name:
NoneFormula:
C17H16O5N5ClSmiles:
Nc1ncnc2c1c(Oc1ccc(Cl)cc1)nn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1ncnc2c1C(Oc1ccc(Cl)cc1)=N[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.31 |
| AlogP: | 0.47 | Num_rotatable_bonds: | 4 |
| MolWt: | 393.79 | Num_heavy_atoms: | 27 |
| TPSA: | 148.77 | NumAromaticRings: | 3 |
Unique Aglycone
AD22707
Formula: C12H7ON5Cl
Smiles:
Nc1ncnc2c1C(Oc1ccc(Cl)cc1)=N[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.7 | Num_rotatable_bonds: | 1 |
| MolWt: | 260.66 | Num_heavy_atoms: | 18 |
| TPSA: | 87.49 | NumAromaticRings: | 2 |
