Glycoside
GD023969
Name:
NoneFormula:
C18H22O4N6Smiles:
OC[C@@H]1O[C@H](n2cnc3c(NCCNc4ccccc4)ncnc32)[C@H](O)[C@H]1OAglycone:
C1=Nc2c(ncnc2NCCNc2ccccc2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.39 |
| AlogP: | -0.04 | Num_rotatable_bonds: | 7 |
| MolWt: | 386.41 | Num_heavy_atoms: | 28 |
| TPSA: | 137.58 | NumAromaticRings: | 3 |
Unique Aglycone
AD16064
Formula: C13H13N6
Smiles:
C1=Nc2c(ncnc2NCCNc2ccccc2)[N]1| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.15 |
| AlogP: | 1.91 | Num_rotatable_bonds: | 5 |
| MolWt: | 253.29 | Num_heavy_atoms: | 19 |
| TPSA: | 76.3 | NumAromaticRings: | 2 |
