Glycoside
GD015026
Name:
NoneFormula:
C14H15O4N5SSmiles:
Nc1nc(-c2cccs2)c2ncn([C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)c2n1Aglycone:
Nc1nc2c(c(-c3cccs3)n1)N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.36 |
| AlogP: | -0.25 | Num_rotatable_bonds: | 3 |
| MolWt: | 349.37 | Num_heavy_atoms: | 24 |
| TPSA: | 139.54 | NumAromaticRings: | 3 |
Unique Aglycone
AD10984
Formula: C9H6N5S
Smiles:
Nc1nc2c(c(-c3cccs3)n1)N=C[N]2| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.7 | Num_rotatable_bonds: | 1 |
| MolWt: | 216.25 | Num_heavy_atoms: | 15 |
| TPSA: | 78.26 | NumAromaticRings: | 2 |
