Glycoside
GD028058
Name:
NoneFormula:
C17H14O5N2Cl2SSmiles:
O=C(Nc1cccc(Cl)c1Cl)c1csc([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)n1Aglycone:
O=C(Nc1cccc(Cl)c1Cl)c1cscn1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 1.86 | Num_rotatable_bonds: | 4 |
| MolWt: | 405.26 | Num_heavy_atoms: | 25 |
| TPSA: | 111.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD18369
Formula: C12H6ON2Cl2S
Smiles:
O=C(Nc1cccc(Cl)c1Cl)c1cscn1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 3.7 | Num_rotatable_bonds: | 2 |
| MolWt: | 273.14 | Num_heavy_atoms: | 16 |
| TPSA: | 41.99 | NumAromaticRings: | 2 |
