Glycoside
GD016361
Name:
NoneFormula:
C21H20O4N5FSmiles:
OC[C@@H]1OC(n2cnc3c(NCc4cccc5ccccc45)nc(F)nc32)[C@H](O)[C@H]1OAglycone:
Fc1nc2c(c(NCc3cccc4ccccc34)n1)N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.29 |
| AlogP: | 1.34 | Num_rotatable_bonds: | 5 |
| MolWt: | 425.42 | Num_heavy_atoms: | 31 |
| TPSA: | 125.55 | NumAromaticRings: | 4 |
Unique Aglycone
AD11794
Formula: C16H11N5F
Smiles:
Fc1nc2c(c(NCc3cccc4ccccc34)n1)N=C[N]2| HBA: | 5 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.06 |
| AlogP: | 3.29 | Num_rotatable_bonds: | 3 |
| MolWt: | 292.3 | Num_heavy_atoms: | 22 |
| TPSA: | 64.27 | NumAromaticRings: | 3 |
