Glycoside
GD027658
Name:
NoneFormula:
C16H15O4N4ClSmiles:
Nc1ncnc2c1c1c(Cl)cccc1n2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1ncnc2c1-c1c(Cl)cccc1[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | 0.43 | Num_rotatable_bonds: | 2 |
| MolWt: | 350.76 | Num_heavy_atoms: | 24 |
| TPSA: | 126.65 | NumAromaticRings: | 3 |
Unique Aglycone
AD18149
Formula: C11H6N4Cl
Smiles:
Nc1ncnc2c1-c1c(Cl)cccc1[N]2| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.26 | Num_rotatable_bonds: | 0 |
| MolWt: | 217.64 | Num_heavy_atoms: | 15 |
| TPSA: | 65.9 | NumAromaticRings: | 2 |
