Glycoside
GD061182
Name:
NoneFormula:
C15H20O5N3ClSmiles:
OC[C@H]1O[C@@H](O)[C@H](Nc2nc(Cl)nc3c2CCCC3)[C@@H](O)[C@@H]1OAglycone:
Nc1nc(Cl)nc2c1CCCC2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.71 |
| AlogP: | -0.78 | Num_rotatable_bonds: | 3 |
| MolWt: | 345.78 | Num_heavy_atoms: | 23 |
| TPSA: | 127.96 | NumAromaticRings: | 1 |
Unique Aglycone
AD30043
Formula: C9H10N3Cl
Smiles:
Nc1nc(Cl)nc2c1CCCC2| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 1.59 | Num_rotatable_bonds: | 0 |
| MolWt: | 183.64 | Num_heavy_atoms: | 12 |
| TPSA: | 51.8 | NumAromaticRings: | 1 |
