Glycoside
GD102391
Name:
NoneFormula:
C19H20O6N5BrSmiles:
COC(=O)Cc1ccc(Nc2ncnc3c2nc(Br)n3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1Aglycone:
COC(=O)Cc1ccc(Nc2ncnc3c2N=C(Br)[N]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.37 |
| AlogP: | 0.66 | Num_rotatable_bonds: | 6 |
| MolWt: | 494.3 | Num_heavy_atoms: | 31 |
| TPSA: | 151.85 | NumAromaticRings: | 3 |
Unique Aglycone
AD43332
Formula: C14H11O2N5Br
Smiles:
COC(=O)Cc1ccc(Nc2ncnc3c2N=C(Br)[N]3)cc1| HBA: | 7 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 2.57 | Num_rotatable_bonds: | 4 |
| MolWt: | 361.18 | Num_heavy_atoms: | 22 |
| TPSA: | 90.57 | NumAromaticRings: | 2 |
