Glycoside
GD091505
Name:
NoneFormula:
C16H23O5N5S2Smiles:
C[S@@](=O)CCCNC(=S)Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CS(=O)CCCNC(=S)Nc1ncnc2c1C=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -0.9 | Num_rotatable_bonds: | 7 |
| MolWt: | 429.52 | Num_heavy_atoms: | 28 |
| TPSA: | 141.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD39939
Formula: C11H14ON5S2
Smiles:
CS(=O)CCCNC(=S)Nc1ncnc2c1C=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.36 |
| AlogP: | 0.75 | Num_rotatable_bonds: | 5 |
| MolWt: | 296.4 | Num_heavy_atoms: | 19 |
| TPSA: | 81.01 | NumAromaticRings: | 1 |
