Glycoside
GD100781
Name:
NoneFormula:
C19H19O6N4ClSSmiles:
Cc1cccc(Cl)c1S(=O)(=O)Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
Cc1cccc(Cl)c1S(=O)(=O)Nc1ncnc2c1C=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 0.81 | Num_rotatable_bonds: | 5 |
| MolWt: | 454.89 | Num_heavy_atoms: | 30 |
| TPSA: | 146.8 | NumAromaticRings: | 3 |
Unique Aglycone
AD42570
Formula: C14H10O2N4ClS
Smiles:
Cc1cccc(Cl)c1S(=O)(=O)Nc1ncnc2c1C=C[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.08 |
| AlogP: | 2.46 | Num_rotatable_bonds: | 3 |
| MolWt: | 321.77 | Num_heavy_atoms: | 21 |
| TPSA: | 86.05 | NumAromaticRings: | 2 |
