Glycoside
GD038931
Name:
5'-deoxy-2-ethynyl-5'-fluoroadenosineFormula:
C12H12O3N5FSmiles:
C#Cc1nc(N)c2ncn([C@H]3O[C@H](CF)[C@H](O)[C@@H]3O)c2n1Aglycone:
C#Cc1nc(N)c2c(n1)[N]C=N2Sugarmoiety:
OC1OC(CF)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | -1.02 | Num_rotatable_bonds: | 2 |
| MolWt: | 293.26 | Num_heavy_atoms: | 21 |
| TPSA: | 119.31 | NumAromaticRings: | 2 |
Unique Aglycone
AD00049
Formula: C7H4N5
Smiles:
C#Cc1nc(N)c2c(n1)[N]C=N2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.05 | Num_rotatable_bonds: | 0 |
| MolWt: | 158.14 | Num_heavy_atoms: | 12 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
