Glycoside
GD085789
Name:
NoneFormula:
C20H24O4N6Smiles:
OC[C@H]1O[C@@H](n2cnc3c(N4CCC(c5cccnc5)CC4)ncnc32)[C@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2N2CCC(c3cccnc3)CC2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | 0.22 | Num_rotatable_bonds: | 4 |
| MolWt: | 412.45 | Num_heavy_atoms: | 30 |
| TPSA: | 129.65 | NumAromaticRings: | 3 |
Unique Aglycone
AD38206
Formula: C15H15N6
Smiles:
C1=Nc2c(ncnc2N2CCC(c3cccnc3)CC2)[N]1| HBA: | 6 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.33 |
| AlogP: | 2.16 | Num_rotatable_bonds: | 2 |
| MolWt: | 279.33 | Num_heavy_atoms: | 21 |
| TPSA: | 68.37 | NumAromaticRings: | 2 |
