Glycoside
GD077934
Name:
NoneFormula:
C17H18O4N5FSmiles:
CO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(Nc3cccc(F)c3)ncnc21Aglycone:
Fc1cccc(Nc2ncnc3c2N=C[N]3)c1Sugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.35 |
| AlogP: | 0.97 | Num_rotatable_bonds: | 5 |
| MolWt: | 375.36 | Num_heavy_atoms: | 27 |
| TPSA: | 114.55 | NumAromaticRings: | 3 |
Unique Aglycone
AD19641
Formula: C11H7N5F
Smiles:
Fc1cccc(Nc2ncnc3c2N=C[N]3)c1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 2.27 | Num_rotatable_bonds: | 2 |
| MolWt: | 228.21 | Num_heavy_atoms: | 17 |
| TPSA: | 64.27 | NumAromaticRings: | 2 |
