Glycoside
GD070320
Name:
NoneFormula:
C17H19O5N5Smiles:
COc1ccc(Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)cc1Aglycone:
COc1ccc(Nc2ncnc3c2N=C[N]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.35 |
| AlogP: | 0.19 | Num_rotatable_bonds: | 5 |
| MolWt: | 373.37 | Num_heavy_atoms: | 27 |
| TPSA: | 134.78 | NumAromaticRings: | 3 |
Unique Aglycone
AD04170
Formula: C12H10ON5
Smiles:
COc1ccc(Nc2ncnc3c2N=C[N]3)cc1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.08 |
| AlogP: | 2.14 | Num_rotatable_bonds: | 3 |
| MolWt: | 240.25 | Num_heavy_atoms: | 18 |
| TPSA: | 73.5 | NumAromaticRings: | 2 |
