Glycoside
GD016841
Name:
NoneFormula:
C19H22O5N5BrSmiles:
OCC(O)C(O)C(O)C(O)CNc1cc2ncnc(Nc3cccc(Br)c3)c2cn1Aglycone:
CNc1cc2ncnc(Nc3cccc(Br)c3)c2cn1Sugarmoiety:
OCC(O)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.32 |
| AlogP: | 0.38 | Num_rotatable_bonds: | 9 |
| MolWt: | 480.32 | Num_heavy_atoms: | 30 |
| TPSA: | 163.88 | NumAromaticRings: | 3 |
Unique Aglycone
AD12073
Formula: C14H12N5Br
Smiles:
CNc1cc2ncnc(Nc3cccc(Br)c3)c2cn1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.07 |
| AlogP: | 3.57 | Num_rotatable_bonds: | 3 |
| MolWt: | 330.19 | Num_heavy_atoms: | 20 |
| TPSA: | 62.73 | NumAromaticRings: | 3 |
