Glycoside
GD004901
Name:
NoneFormula:
C21H28O4N6Smiles:
CCCCNc1nc(NCc2ccccc2)nc2c1ncn2C1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CCCCNc1nc(NCc2ccccc2)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.48 |
| AlogP: | 1.26 | Num_rotatable_bonds: | 9 |
| MolWt: | 428.49 | Num_heavy_atoms: | 31 |
| TPSA: | 137.58 | NumAromaticRings: | 3 |
Unique Aglycone
AD04227
Formula: C16H19N6
Smiles:
CCCCNc1nc(NCc2ccccc2)nc2c1N=C[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.31 |
| AlogP: | 3.21 | Num_rotatable_bonds: | 7 |
| MolWt: | 295.37 | Num_heavy_atoms: | 22 |
| TPSA: | 76.3 | NumAromaticRings: | 2 |
