Glycoside
GD091277
Name:
NoneFormula:
C19H22O5N6SSmiles:
COc1ccc(CNC(=S)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1Aglycone:
COc1ccc(CNC(=S)Nc2ncnc3c2N=C[N]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.37 |
| AlogP: | -0.07 | Num_rotatable_bonds: | 6 |
| MolWt: | 446.49 | Num_heavy_atoms: | 31 |
| TPSA: | 146.81 | NumAromaticRings: | 3 |
Unique Aglycone
AD39808
Formula: C14H13ON6S
Smiles:
COc1ccc(CNC(=S)Nc2ncnc3c2N=C[N]3)cc1| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 1.88 | Num_rotatable_bonds: | 4 |
| MolWt: | 313.37 | Num_heavy_atoms: | 22 |
| TPSA: | 85.53 | NumAromaticRings: | 2 |
