Glycoside
GD023773
Name:
NoneFormula:
C20H20O5N3ClSSmiles:
OC[C@@H]1O[C@H](c2ccc(Cl)c(Cn3nc4ccccn4c3=S)c2)[C@H](O)[C@H](O)[C@H]1OAglycone:
S=c1n(Cc2ccccc2Cl)nc2ccccn12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.37 |
| AlogP: | 1.08 | Num_rotatable_bonds: | 4 |
| MolWt: | 437.91 | Num_heavy_atoms: | 29 |
| TPSA: | 112.38 | NumAromaticRings: | 3 |
Unique Aglycone
AD15961
Formula: C14H10N3ClS
Smiles:
S=c1n(Cc2ccccc2Cl)nc2ccccn12| HBA: | 3 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.08 |
| AlogP: | 3.57 | Num_rotatable_bonds: | 2 |
| MolWt: | 275.76 | Num_heavy_atoms: | 18 |
| TPSA: | 22.23 | NumAromaticRings: | 3 |
