Glycoside
GD090718
Name:
NoneFormula:
C20H22O5N6Smiles:
O=C1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCN1c1ccccc1Aglycone:
O=C1CN(c2ncnc3c2N=C[N]3)CCN1c1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.4 |
| AlogP: | -0.71 | Num_rotatable_bonds: | 4 |
| MolWt: | 426.43 | Num_heavy_atoms: | 31 |
| TPSA: | 137.07 | NumAromaticRings: | 3 |
Unique Aglycone
AD39489
Formula: C15H13ON6
Smiles:
O=C1CN(c2ncnc3c2N=C[N]3)CCN1c1ccccc1| HBA: | 7 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.2 |
| AlogP: | 1.24 | Num_rotatable_bonds: | 2 |
| MolWt: | 293.31 | Num_heavy_atoms: | 22 |
| TPSA: | 75.79 | NumAromaticRings: | 2 |
