Glycoside
GD085147
Name:
NoneFormula:
C13H19O7N5FPSmiles:
CC(C)=Nc1nc(F)nc2c1ncn2[C@@H]1O[C@H](CO[PH](O)(O)O)[C@@H](O)[C@@H]1OAglycone:
CC(C)=Nc1nc(F)nc2c1N=C[N]2.CO[PH](O)(O)OSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | -0.9 | Num_rotatable_bonds: | 5 |
| MolWt: | 407.3 | Num_heavy_atoms: | 27 |
| TPSA: | 175.57 | NumAromaticRings: | 2 |
Unique Aglycone
AD01852
Formula: CH7O4P
Smiles:
CO[PH](O)(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -0.98 | Num_rotatable_bonds: | 1 |
| MolWt: | 114.04 | Num_heavy_atoms: | 6 |
| TPSA: | 69.92 | NumAromaticRings: | 0 |
AD30235
Formula: C8H7N5F
Smiles:
CC(C)=Nc1nc(F)nc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.25 |
| AlogP: | 1.64 | Num_rotatable_bonds: | 1 |
| MolWt: | 192.18 | Num_heavy_atoms: | 14 |
| TPSA: | 64.6 | NumAromaticRings: | 1 |
