Glycoside
GD084542
Name:
NoneFormula:
C14H15O6N3Cl2SSmiles:
CSc1nc(Cl)c(C(=O)N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c(Cl)n1Aglycone:
CSc1nc(Cl)c(C(N)=O)c(Cl)n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -0.97 | Num_rotatable_bonds: | 4 |
| MolWt: | 400.24 | Num_heavy_atoms: | 24 |
| TPSA: | 145.03 | NumAromaticRings: | 1 |
Unique Aglycone
AD37770
Formula: C8H5ON3Cl2S
Smiles:
CSc1nc(Cl)c(C(N)=O)c(Cl)n1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 1.6 | Num_rotatable_bonds: | 2 |
| MolWt: | 238.1 | Num_heavy_atoms: | 13 |
| TPSA: | 68.87 | NumAromaticRings: | 1 |
