Glycoside
GD010857
Name:
NoneFormula:
C22H20O3N5FSmiles:
Nc1cccc(-c2cn([C@@H]3OC[C@H](O)[C@H]3O)c3ncnc(Nc4ccc(F)cc4)c23)c1Aglycone:
Nc1cccc(C2=C[N]c3ncnc(Nc4ccc(F)cc4)c32)c1Sugarmoiety:
OC1COC(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.18 |
| AlogP: | 2.81 | Num_rotatable_bonds: | 4 |
| MolWt: | 421.43 | Num_heavy_atoms: | 31 |
| TPSA: | 118.45 | NumAromaticRings: | 4 |
Unique Aglycone
AD08333
Formula: C18H13N5F
Smiles:
Nc1cccc(C2=C[N]c3ncnc(Nc4ccc(F)cc4)c32)c1| HBA: | 5 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 3.58 | Num_rotatable_bonds: | 3 |
| MolWt: | 318.34 | Num_heavy_atoms: | 24 |
| TPSA: | 77.93 | NumAromaticRings: | 3 |
