Glycoside
GD101787
Name:
NoneFormula:
C19H15O4N6Cl3Smiles:
N=c1nc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(N)n1-c1cc(Cl)c(Cl)c(Cl)c1Aglycone:
N=c1nc2c(c(N)n1-c1cc(Cl)c(Cl)c(Cl)c1)N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.31 |
| AlogP: | 0.86 | Num_rotatable_bonds: | 3 |
| MolWt: | 461.69 | Num_heavy_atoms: | 29 |
| TPSA: | 155.43 | NumAromaticRings: | 3 |
Unique Aglycone
AD43101
Formula: C14H6N6Cl3
Smiles:
N=c1nc2c(c(N)n1-c1cc(Cl)c(Cl)c(Cl)c1)N=C[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 2.8 | Num_rotatable_bonds: | 1 |
| MolWt: | 328.57 | Num_heavy_atoms: | 20 |
| TPSA: | 94.15 | NumAromaticRings: | 2 |
