Glycoside
GD021808
Name:
NoneFormula:
C24H24O4N4Smiles:
CCOc1ccc(Nc2ncnc3c2c(-c2ccccc2)cn3[C@@H]2OC[C@H](O)[C@H]2O)cc1Aglycone:
CCOc1ccc(Nc2ncnc3c2C(c2ccccc2)=C[N]3)cc1Sugarmoiety:
OC1COC(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | 3.49 | Num_rotatable_bonds: | 6 |
| MolWt: | 432.48 | Num_heavy_atoms: | 32 |
| TPSA: | 101.66 | NumAromaticRings: | 4 |
Unique Aglycone
AD14852
Formula: C20H17ON4
Smiles:
CCOc1ccc(Nc2ncnc3c2C(c2ccccc2)=C[N]3)cc1| HBA: | 5 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.1 |
| AlogP: | 4.26 | Num_rotatable_bonds: | 5 |
| MolWt: | 329.38 | Num_heavy_atoms: | 25 |
| TPSA: | 61.14 | NumAromaticRings: | 3 |
