Glycoside
GD012068
Name:
NoneFormula:
C24H24O4N6Smiles:
OC[C@@H]1O[C@H](n2c(N3CCc4ccccc43)nc3c(Nc4ccccc4)ncnc32)[C@H](O)[C@H]1OAglycone:
c1ccc(Nc2ncnc3c2N=C(N2CCc4ccccc42)[N]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.29 |
| AlogP: | 1.88 | Num_rotatable_bonds: | 5 |
| MolWt: | 460.49 | Num_heavy_atoms: | 34 |
| TPSA: | 128.79 | NumAromaticRings: | 4 |
Unique Aglycone
AD09122
Formula: C19H15N6
Smiles:
c1ccc(Nc2ncnc3c2N=C(N2CCc4ccccc42)[N]3)cc1| HBA: | 6 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.11 |
| AlogP: | 3.52 | Num_rotatable_bonds: | 2 |
| MolWt: | 327.37 | Num_heavy_atoms: | 25 |
| TPSA: | 67.51 | NumAromaticRings: | 3 |
