Glycoside
GD020563
Name:
NoneFormula:
C13H13O4N5SSmiles:
OC[C@@H]1OC(n2cnc3c(-c4nccs4)ncnc32)[C@H](O)[C@H]1OAglycone:
C1=Nc2c(ncnc2-c2nccs2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.38 |
| AlogP: | -0.44 | Num_rotatable_bonds: | 3 |
| MolWt: | 335.35 | Num_heavy_atoms: | 23 |
| TPSA: | 126.41 | NumAromaticRings: | 3 |
Unique Aglycone
AD14185
Formula: C8H4N5S
Smiles:
C1=Nc2c(ncnc2-c2nccs2)[N]1| HBA: | 5 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 1.51 | Num_rotatable_bonds: | 1 |
| MolWt: | 202.22 | Num_heavy_atoms: | 14 |
| TPSA: | 65.13 | NumAromaticRings: | 2 |
