Glycoside
GD091061
Name:
NoneFormula:
C19H22O4N7FSmiles:
OC[C@H]1O[C@@H](n2cnc3c(N4CCN(c5ccc(F)cn5)CC4)ncnc32)[C@H](O)[C@@H]1OAglycone:
Fc1ccc(N2CCN(c3ncnc4c3N=C[N]4)CC2)nc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.47 |
| AlogP: | -0.7 | Num_rotatable_bonds: | 4 |
| MolWt: | 431.43 | Num_heavy_atoms: | 31 |
| TPSA: | 132.89 | NumAromaticRings: | 3 |
Unique Aglycone
AD39681
Formula: C14H13N7F
Smiles:
Fc1ccc(N2CCN(c3ncnc4c3N=C[N]4)CC2)nc1| HBA: | 7 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.29 |
| AlogP: | 1.25 | Num_rotatable_bonds: | 2 |
| MolWt: | 298.31 | Num_heavy_atoms: | 22 |
| TPSA: | 71.61 | NumAromaticRings: | 2 |
