Glycoside
GD070563
Name:
NoneFormula:
C15H16O4N3ClSSmiles:
OC[C@H](O)[C@H](O)[C@H](O)C/N=N/c1nc(-c2ccc(Cl)cc2)cs1Aglycone:
CN=Nc1nc(-c2ccc(Cl)cc2)cs1Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.36 |
| AlogP: | 1.62 | Num_rotatable_bonds: | 7 |
| MolWt: | 357.82 | Num_heavy_atoms: | 23 |
| TPSA: | 118.53 | NumAromaticRings: | 2 |
Unique Aglycone
AD33443
Formula: C11H8N3ClS
Smiles:
CN=Nc1nc(-c2ccc(Cl)cc2)cs1| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.1 |
| AlogP: | 4.18 | Num_rotatable_bonds: | 2 |
| MolWt: | 237.72 | Num_heavy_atoms: | 15 |
| TPSA: | 37.61 | NumAromaticRings: | 2 |
