Glycoside
GD098847
Name:
NoneFormula:
C20H27O7N3SSmiles:
COCCn1nc(C)cc1C(=O)Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc1Aglycone:
COCCn1nc(C)cc1C(=O)Nc1ccc(S)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.02 | Num_rotatable_bonds: | 8 |
| MolWt: | 453.52 | Num_heavy_atoms: | 31 |
| TPSA: | 146.3 | NumAromaticRings: | 2 |
Unique Aglycone
AD42053
Formula: C14H17O2N3S
Smiles:
COCCn1nc(C)cc1C(=O)Nc1ccc(S)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.29 |
| AlogP: | 2.38 | Num_rotatable_bonds: | 5 |
| MolWt: | 291.38 | Num_heavy_atoms: | 20 |
| TPSA: | 56.15 | NumAromaticRings: | 2 |
