Glycoside
GD070231
Name:
NoneFormula:
C14H16O4N6SSmiles:
CO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(Nc3nccs3)ncnc21Aglycone:
C1=Nc2c(ncnc2Nc2nccs2)[N]1Sugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.43 |
| AlogP: | 0.29 | Num_rotatable_bonds: | 5 |
| MolWt: | 364.39 | Num_heavy_atoms: | 25 |
| TPSA: | 127.44 | NumAromaticRings: | 3 |
Unique Aglycone
AD32251
Formula: C8H5N6S
Smiles:
C1=Nc2c(ncnc2Nc2nccs2)[N]1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.59 | Num_rotatable_bonds: | 2 |
| MolWt: | 217.24 | Num_heavy_atoms: | 15 |
| TPSA: | 77.16 | NumAromaticRings: | 2 |
