Glycoside
GD061236
Name:
NoneFormula:
C15H22O5N3ClSmiles:
Cc1c(Cl)nc(C(C)C)nc1N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
Cc1c(N)nc(C(C)C)nc1ClSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.71 |
| AlogP: | -0.23 | Num_rotatable_bonds: | 4 |
| MolWt: | 347.8 | Num_heavy_atoms: | 23 |
| TPSA: | 127.96 | NumAromaticRings: | 1 |
Unique Aglycone
AD30074
Formula: C9H12N3Cl
Smiles:
Cc1c(N)nc(C(C)C)nc1Cl| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 2.14 | Num_rotatable_bonds: | 1 |
| MolWt: | 185.66 | Num_heavy_atoms: | 12 |
| TPSA: | 51.8 | NumAromaticRings: | 1 |
