Glycoside
GD077065
Name:
NoneFormula:
C15H18O4N6SSmiles:
OC[C@H]1O[C@@H](n2cnc3c(NCCc4nccs4)ncnc32)[C@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2NCCc2nccs2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -0.45 | Num_rotatable_bonds: | 6 |
| MolWt: | 378.41 | Num_heavy_atoms: | 26 |
| TPSA: | 138.44 | NumAromaticRings: | 3 |
Unique Aglycone
AD35393
Formula: C10H9N6S
Smiles:
C1=Nc2c(ncnc2NCCc2nccs2)[N]1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.2 |
| AlogP: | 1.5 | Num_rotatable_bonds: | 4 |
| MolWt: | 245.29 | Num_heavy_atoms: | 17 |
| TPSA: | 77.16 | NumAromaticRings: | 2 |
