Glycoside
GD090306
Name:
NoneFormula:
C15H17O5N5FBrSmiles:
O=C(Nc1nc(F)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1(Br)CCC1Aglycone:
O=C(Nc1nc(F)nc2c1N=C[N]2)C1(Br)CCC1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.6 |
| AlogP: | -0.17 | Num_rotatable_bonds: | 4 |
| MolWt: | 446.23 | Num_heavy_atoms: | 27 |
| TPSA: | 142.62 | NumAromaticRings: | 2 |
Unique Aglycone
AD39313
Formula: C10H8ON5FBr
Smiles:
O=C(Nc1nc(F)nc2c1N=C[N]2)C1(Br)CCC1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.4 |
| AlogP: | 1.78 | Num_rotatable_bonds: | 2 |
| MolWt: | 313.11 | Num_heavy_atoms: | 18 |
| TPSA: | 81.34 | NumAromaticRings: | 1 |
