Glycoside
GD091971
Name:
NoneFormula:
C20H24O4N7FSmiles:
OC[C@H]1O[C@@H](n2cnc3c(N4CCCN(c5ncccc5F)CC4)ncnc32)[C@H](O)[C@@H]1OAglycone:
Fc1cccnc1N1CCCN(c2ncnc3c2N=C[N]3)CC1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | -0.31 | Num_rotatable_bonds: | 4 |
| MolWt: | 445.46 | Num_heavy_atoms: | 32 |
| TPSA: | 132.89 | NumAromaticRings: | 3 |
Unique Aglycone
AD40138
Formula: C15H15N7F
Smiles:
Fc1cccnc1N1CCCN(c2ncnc3c2N=C[N]3)CC1| HBA: | 7 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.33 |
| AlogP: | 1.64 | Num_rotatable_bonds: | 2 |
| MolWt: | 312.33 | Num_heavy_atoms: | 23 |
| TPSA: | 71.61 | NumAromaticRings: | 2 |
