Glycoside
GD006839
Name:
NoneFormula:
C15H18O4N6S2Smiles:
CSc1nc(SC)c2c3c(N)ncnc3n(C3O[C@H](CO)[C@H](O)[C@H]3O)c2n1Aglycone:
CSc1nc2c(c(SC)n1)-c1c(N)ncnc1[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | 0.01 | Num_rotatable_bonds: | 4 |
| MolWt: | 410.48 | Num_heavy_atoms: | 27 |
| TPSA: | 152.43 | NumAromaticRings: | 3 |
Unique Aglycone
AD05619
Formula: C10H9N6S2
Smiles:
CSc1nc2c(c(SC)n1)-c1c(N)ncnc1[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.2 |
| AlogP: | 1.84 | Num_rotatable_bonds: | 2 |
| MolWt: | 277.36 | Num_heavy_atoms: | 18 |
| TPSA: | 91.68 | NumAromaticRings: | 2 |
