Glycoside
GD084340
Name:
NoneFormula:
C17H20O5N6SSmiles:
O=C(NCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)c1cccs1Aglycone:
O=C(NCCNc1ncnc2c1N=C[N]2)c1cccs1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.41 |
| AlogP: | -0.66 | Num_rotatable_bonds: | 7 |
| MolWt: | 420.45 | Num_heavy_atoms: | 29 |
| TPSA: | 154.65 | NumAromaticRings: | 3 |
Unique Aglycone
AD37651
Formula: C12H11ON6S
Smiles:
O=C(NCCNc1ncnc2c1N=C[N]2)c1cccs1| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 1.29 | Num_rotatable_bonds: | 5 |
| MolWt: | 287.33 | Num_heavy_atoms: | 20 |
| TPSA: | 93.37 | NumAromaticRings: | 2 |
