Glycoside
GD102332
Name:
NoneFormula:
C17H15O6N5FBrSmiles:
O=C(Nc1nc(F)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)Oc1ccc(Br)cc1Aglycone:
O=C(Nc1nc(F)nc2c1N=C[N]2)Oc1ccc(Br)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.29 |
| AlogP: | 0.95 | Num_rotatable_bonds: | 4 |
| MolWt: | 484.24 | Num_heavy_atoms: | 30 |
| TPSA: | 151.85 | NumAromaticRings: | 3 |
Unique Aglycone
AD43308
Formula: C12H6O2N5FBr
Smiles:
O=C(Nc1nc(F)nc2c1N=C[N]2)Oc1ccc(Br)cc1| HBA: | 7 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 2.9 | Num_rotatable_bonds: | 2 |
| MolWt: | 351.12 | Num_heavy_atoms: | 21 |
| TPSA: | 90.57 | NumAromaticRings: | 2 |
