Glycoside
GD014491
Name:
NoneFormula:
C21H15O4N4FCl2Smiles:
OCC(O)C(O)C(O)c1nn(-c2ccc(F)cc2)c2nc3cc(Cl)c(Cl)cc3nc12Aglycone:
Fc1ccc(-n2ncc3nc4cc(Cl)c(Cl)cc4nc32)cc1Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.21 |
| AlogP: | 2.16 | Num_rotatable_bonds: | 5 |
| MolWt: | 453.26 | Num_heavy_atoms: | 30 |
| TPSA: | 124.52 | NumAromaticRings: | 4 |
Unique Aglycone
AD10645
Formula: C17H7N4FCl2
Smiles:
Fc1ccc(-n2ncc3nc4cc(Cl)c(Cl)cc4nc32)cc1| HBA: | 4 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 4.41 | Num_rotatable_bonds: | 1 |
| MolWt: | 333.15 | Num_heavy_atoms: | 22 |
| TPSA: | 43.6 | NumAromaticRings: | 4 |
