Glycoside
GD033471
Name:
NoneFormula:
C19H17O4N6ClSmiles:
N#Cc1ccc(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c(Cl)c1Aglycone:
N#Cc1ccc(CNc2ncnc3c2N=C[N]3)c(Cl)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 0.57 | Num_rotatable_bonds: | 5 |
| MolWt: | 416.83 | Num_heavy_atoms: | 29 |
| TPSA: | 149.34 | NumAromaticRings: | 3 |
Unique Aglycone
AD21363
Formula: C14H8N6Cl
Smiles:
N#Cc1ccc(CNc2ncnc3c2N=C[N]3)c(Cl)c1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.08 |
| AlogP: | 2.52 | Num_rotatable_bonds: | 3 |
| MolWt: | 283.7 | Num_heavy_atoms: | 20 |
| TPSA: | 88.06 | NumAromaticRings: | 2 |
