Glycoside
GD020496
Name:
NoneFormula:
C17H16O4N3ClSSmiles:
CSc1ncnc2c1c1cc(Cl)ccc1n2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CSc1ncnc2c1-c1cc(Cl)ccc1[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.38 |
| AlogP: | 1.57 | Num_rotatable_bonds: | 3 |
| MolWt: | 381.84 | Num_heavy_atoms: | 25 |
| TPSA: | 100.63 | NumAromaticRings: | 3 |
Unique Aglycone
AD14147
Formula: C12H7N3ClS
Smiles:
CSc1ncnc2c1-c1cc(Cl)ccc1[N]2| HBA: | 3 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.09 |
| AlogP: | 3.4 | Num_rotatable_bonds: | 1 |
| MolWt: | 248.72 | Num_heavy_atoms: | 16 |
| TPSA: | 39.88 | NumAromaticRings: | 2 |
