Glycoside
GD091165
Name:
NoneFormula:
C19H24O6N4SSmiles:
CN(C)c1nccc(C(=O)Nc2ccc(S[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2)n1Aglycone:
CN(C)c1nccc(C(=O)Nc2ccc(S)cc2)n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -0.31 | Num_rotatable_bonds: | 6 |
| MolWt: | 436.49 | Num_heavy_atoms: | 30 |
| TPSA: | 148.27 | NumAromaticRings: | 2 |
Unique Aglycone
AD39739
Formula: C13H14ON4S
Smiles:
CN(C)c1nccc(C(=O)Nc2ccc(S)cc2)n1| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.15 |
| AlogP: | 2.08 | Num_rotatable_bonds: | 3 |
| MolWt: | 274.35 | Num_heavy_atoms: | 19 |
| TPSA: | 58.12 | NumAromaticRings: | 2 |
