Glycoside
GD084017
Name:
NoneFormula:
C14H17O4N7S2Smiles:
CCNc1nnc(Sc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)s1Aglycone:
CCNc1nnc(Sc2ncnc3c2N=C[N]3)s1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -0.13 | Num_rotatable_bonds: | 6 |
| MolWt: | 411.47 | Num_heavy_atoms: | 27 |
| TPSA: | 151.33 | NumAromaticRings: | 3 |
Unique Aglycone
AD37487
Formula: C9H8N7S2
Smiles:
CCNc1nnc(Sc2ncnc3c2N=C[N]3)s1| HBA: | 7 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.22 |
| AlogP: | 1.82 | Num_rotatable_bonds: | 4 |
| MolWt: | 278.35 | Num_heavy_atoms: | 18 |
| TPSA: | 90.05 | NumAromaticRings: | 2 |
