Glycoside
GD075312
Name:
NoneFormula:
C17H25O4N7Smiles:
OC[C@H]1O[C@@H](n2cnc3c(NC[C@H]4CN5CCN4CC5)ncnc32)[C@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2NCC2CN3CCN2CC3)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | -2.15 | Num_rotatable_bonds: | 5 |
| MolWt: | 391.43 | Num_heavy_atoms: | 28 |
| TPSA: | 132.03 | NumAromaticRings: | 2 |
Unique Aglycone
AD34878
Formula: C12H16N7
Smiles:
C1=Nc2c(ncnc2NCC2CN3CCN2CC3)[N]1| HBA: | 7 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.58 |
| AlogP: | -0.2 | Num_rotatable_bonds: | 3 |
| MolWt: | 258.31 | Num_heavy_atoms: | 19 |
| TPSA: | 70.75 | NumAromaticRings: | 1 |
