Glycoside
GD063870
Name:
NoneFormula:
C14H16O4N6SSmiles:
N=c1nc2c(ncn2[C@@H]2O[C@H](CO)[C@H](O)[C@@H]2O)c(N)n1-c1ccsc1Aglycone:
N=c1nc2c(c(N)n1-c1ccsc1)N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.36 |
| AlogP: | -1.04 | Num_rotatable_bonds: | 3 |
| MolWt: | 364.39 | Num_heavy_atoms: | 25 |
| TPSA: | 155.43 | NumAromaticRings: | 3 |
Unique Aglycone
AD30721
Formula: C9H7N6S
Smiles:
N=c1nc2c(c(N)n1-c1ccsc1)N=C[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 0.9 | Num_rotatable_bonds: | 1 |
| MolWt: | 231.26 | Num_heavy_atoms: | 16 |
| TPSA: | 94.15 | NumAromaticRings: | 2 |
