Glycoside
GD091834
Name:
NoneFormula:
C19H22O6N5FSmiles:
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H](O)COc4cccc(F)c4)ncnc32)[C@H](O)[C@@H]1OAglycone:
OC(CNc1ncnc2c1N=C[N]2)COc1cccc(F)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -0.57 | Num_rotatable_bonds: | 8 |
| MolWt: | 435.41 | Num_heavy_atoms: | 31 |
| TPSA: | 155.01 | NumAromaticRings: | 3 |
Unique Aglycone
AD40047
Formula: C14H13O2N5F
Smiles:
OC(CNc1ncnc2c1N=C[N]2)COc1cccc(F)c1| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.21 |
| AlogP: | 1.38 | Num_rotatable_bonds: | 6 |
| MolWt: | 302.29 | Num_heavy_atoms: | 22 |
| TPSA: | 93.73 | NumAromaticRings: | 2 |
