Glycoside
GD010895
Name:
NoneFormula:
C19H18O4N3ClSmiles:
Nc1ccnc2c1c(-c1ccc(Cl)cc1)cn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1ccnc2c1C(c1ccc(Cl)cc1)=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.28 |
| AlogP: | 1.55 | Num_rotatable_bonds: | 3 |
| MolWt: | 375.81 | Num_heavy_atoms: | 26 |
| TPSA: | 113.76 | NumAromaticRings: | 3 |
Unique Aglycone
AD08359
Formula: C14H9N3Cl
Smiles:
Nc1ccnc2c1C(c1ccc(Cl)cc1)=C[N]2| HBA: | 3 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.96 | Num_rotatable_bonds: | 1 |
| MolWt: | 242.69 | Num_heavy_atoms: | 17 |
| TPSA: | 53.01 | NumAromaticRings: | 2 |
