Glycoside
GD006499
Name:
NoneFormula:
C15H15O4N4FSmiles:
OC[C@@H]1O[C@H](n2cc(F)c3c(-c4cc[nH]c4)ncnc32)[C@H](O)[C@H]1OAglycone:
FC1=C[N]c2ncnc(-c3cc[nH]c3)c21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 0.18 | Num_rotatable_bonds: | 3 |
| MolWt: | 334.31 | Num_heavy_atoms: | 24 |
| TPSA: | 116.42 | NumAromaticRings: | 3 |
Unique Aglycone
AD05373
Formula: C10H6N4F
Smiles:
FC1=C[N]c2ncnc(-c3cc[nH]c3)c21| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.99 | Num_rotatable_bonds: | 1 |
| MolWt: | 201.18 | Num_heavy_atoms: | 15 |
| TPSA: | 55.67 | NumAromaticRings: | 2 |
