Glycoside
GD084855
Name:
NoneFormula:
C16H17O4N7SSmiles:
OC[C@H]1O[C@@H](n2cnc3c(NCc4cn5ccsc5n4)ncnc32)[C@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2NCc2cn3ccsc3n2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.38 |
| AlogP: | -0.24 | Num_rotatable_bonds: | 5 |
| MolWt: | 403.42 | Num_heavy_atoms: | 28 |
| TPSA: | 142.85 | NumAromaticRings: | 4 |
Unique Aglycone
AD37962
Formula: C11H8N7S
Smiles:
C1=Nc2c(ncnc2NCc2cn3ccsc3n2)[N]1| HBA: | 7 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.09 |
| AlogP: | 1.71 | Num_rotatable_bonds: | 3 |
| MolWt: | 270.3 | Num_heavy_atoms: | 19 |
| TPSA: | 81.57 | NumAromaticRings: | 3 |
