Glycoside
GD035904
Name:
NoneFormula:
C18H18O4N6SSmiles:
OC[C@@H]1O[C@H](n2cnc3c(Nc4ccc(CN=C=S)cc4)ncnc32)[C@H](O)[C@H]1OAglycone:
S=C=NCc1ccc(Nc2ncnc3c2N=C[N]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 0.78 | Num_rotatable_bonds: | 6 |
| MolWt: | 414.45 | Num_heavy_atoms: | 29 |
| TPSA: | 137.91 | NumAromaticRings: | 3 |
Unique Aglycone
AD22688
Formula: C13H9N6S
Smiles:
S=C=NCc1ccc(Nc2ncnc3c2N=C[N]3)cc1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.08 |
| AlogP: | 2.73 | Num_rotatable_bonds: | 4 |
| MolWt: | 281.32 | Num_heavy_atoms: | 20 |
| TPSA: | 76.63 | NumAromaticRings: | 2 |
