Glycoside
GD016727
Name:
NoneFormula:
C17H16O4N3ClSmiles:
Cc1ncnc2c1c1cc(Cl)ccc1n2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Cc1ncnc2c1-c1cc(Cl)ccc1[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.38 |
| AlogP: | 1.16 | Num_rotatable_bonds: | 2 |
| MolWt: | 349.77 | Num_heavy_atoms: | 24 |
| TPSA: | 100.63 | NumAromaticRings: | 3 |
Unique Aglycone
AD12006
Formula: C12H7N3Cl
Smiles:
Cc1ncnc2c1-c1cc(Cl)ccc1[N]2| HBA: | 3 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.09 |
| AlogP: | 2.99 | Num_rotatable_bonds: | 0 |
| MolWt: | 216.65 | Num_heavy_atoms: | 15 |
| TPSA: | 39.88 | NumAromaticRings: | 2 |
