Glycoside
GD090948
Name:
NoneFormula:
C19H22O4N7FSmiles:
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4CCN(c5ncccc5F)C4)ncnc32)[C@H](O)[C@@H]1OAglycone:
Fc1cccnc1N1CCC(Nc2ncnc3c2N=C[N]3)C1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -0.34 | Num_rotatable_bonds: | 5 |
| MolWt: | 431.43 | Num_heavy_atoms: | 31 |
| TPSA: | 141.68 | NumAromaticRings: | 3 |
Unique Aglycone
AD39602
Formula: C14H13N7F
Smiles:
Fc1cccnc1N1CCC(Nc2ncnc3c2N=C[N]3)C1| HBA: | 7 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.29 |
| AlogP: | 1.61 | Num_rotatable_bonds: | 3 |
| MolWt: | 298.31 | Num_heavy_atoms: | 22 |
| TPSA: | 80.4 | NumAromaticRings: | 2 |
