Glycoside
GD085787
Name:
NoneFormula:
C19H19O4N5F2Smiles:
OC[C@H]1O[C@@H](n2cnc3c(N4CCc5c(F)cc(F)cc5C4)ncnc32)[C@H](O)[C@@H]1OAglycone:
Fc1cc(F)c2c(c1)CN(c1ncnc3c1N=C[N]3)CC2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.42 |
| AlogP: | 0.28 | Num_rotatable_bonds: | 3 |
| MolWt: | 419.39 | Num_heavy_atoms: | 30 |
| TPSA: | 116.76 | NumAromaticRings: | 3 |
Unique Aglycone
AD38204
Formula: C14H10N5F2
Smiles:
Fc1cc(F)c2c(c1)CN(c1ncnc3c1N=C[N]3)CC2| HBA: | 5 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.21 |
| AlogP: | 2.23 | Num_rotatable_bonds: | 1 |
| MolWt: | 286.27 | Num_heavy_atoms: | 21 |
| TPSA: | 55.48 | NumAromaticRings: | 2 |
