Glycoside
GD011263
Name:
NoneFormula:
C19H23O5N5SSmiles:
COc1ccc(CNc2nc(SC)nc3c2ncn3[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)cc1Aglycone:
COc1ccc(CNc2nc(SC)nc3c2N=C[N]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | 0.78 | Num_rotatable_bonds: | 7 |
| MolWt: | 433.49 | Num_heavy_atoms: | 30 |
| TPSA: | 134.78 | NumAromaticRings: | 3 |
Unique Aglycone
AD08625
Formula: C14H14ON5S
Smiles:
COc1ccc(CNc2nc(SC)nc3c2N=C[N]3)cc1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.21 |
| AlogP: | 2.73 | Num_rotatable_bonds: | 5 |
| MolWt: | 300.37 | Num_heavy_atoms: | 21 |
| TPSA: | 73.5 | NumAromaticRings: | 2 |
