Glycoside
GD002531
Name:
NoneFormula:
C18H22O4N6Smiles:
Cc1ccc(CNc2nc(N)nc3c2ncn3C2O[C@H](CO)[C@H](O)[C@H]2O)cc1Aglycone:
Cc1ccc(CNc2nc(N)nc3c2N=C[N]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.39 |
| AlogP: | -0.06 | Num_rotatable_bonds: | 5 |
| MolWt: | 386.41 | Num_heavy_atoms: | 28 |
| TPSA: | 151.57 | NumAromaticRings: | 3 |
Unique Aglycone
AD02407
Formula: C13H13N6
Smiles:
Cc1ccc(CNc2nc(N)nc3c2N=C[N]3)cc1| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.15 |
| AlogP: | 1.89 | Num_rotatable_bonds: | 3 |
| MolWt: | 253.29 | Num_heavy_atoms: | 19 |
| TPSA: | 90.29 | NumAromaticRings: | 2 |
