Glycoside
GD084679
Name:
NoneFormula:
C17H17O6N2ClSSmiles:
O=C(N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1cnc(-c2ccc(Cl)cc2)s1Aglycone:
NC(=O)c1cnc(-c2ccc(Cl)cc2)s1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -0.01 | Num_rotatable_bonds: | 4 |
| MolWt: | 400.84 | Num_heavy_atoms: | 26 |
| TPSA: | 132.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD37848
Formula: C11H7ON2ClS
Smiles:
NC(=O)c1cnc(-c2ccc(Cl)cc2)s1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.56 | Num_rotatable_bonds: | 2 |
| MolWt: | 238.7 | Num_heavy_atoms: | 15 |
| TPSA: | 55.98 | NumAromaticRings: | 2 |
