Glycoside
GD076755
Name:
NoneFormula:
C14H19O5N4ClSSmiles:
CCS[C@@H]([C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)n1cnc2c(Cl)ncnc21Aglycone:
CCSCn1cnc2c(Cl)ncnc21Sugarmoiety:
OCC(O)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -0.83 | Num_rotatable_bonds: | 8 |
| MolWt: | 378.84 | Num_heavy_atoms: | 24 |
| TPSA: | 144.75 | NumAromaticRings: | 2 |
Unique Aglycone
AD35304
Formula: C9H9N4ClS
Smiles:
CCSCn1cnc2c(Cl)ncnc21| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.38 |
| AlogP: | 2.19 | Num_rotatable_bonds: | 3 |
| MolWt: | 228.71 | Num_heavy_atoms: | 14 |
| TPSA: | 43.6 | NumAromaticRings: | 2 |
