Glycoside
GD001387
Name:
NoneFormula:
C12H18O4N6SSmiles:
NCCSc1nc(N)c2ncn(C3OC(CO)C(O)C3O)c2n1Aglycone:
NCCSc1nc(N)c2c(n1)[N]C=N2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.58 |
| AlogP: | -1.93 | Num_rotatable_bonds: | 5 |
| MolWt: | 342.38 | Num_heavy_atoms: | 23 |
| TPSA: | 165.56 | NumAromaticRings: | 2 |
Unique Aglycone
AD01401
Formula: C7H9N6S
Smiles:
NCCSc1nc(N)c2c(n1)[N]C=N2| HBA: | 6 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.29 |
| AlogP: | 0.02 | Num_rotatable_bonds: | 3 |
| MolWt: | 209.26 | Num_heavy_atoms: | 14 |
| TPSA: | 104.28 | NumAromaticRings: | 1 |
