Glycoside
GD078362
Name:
NoneFormula:
C16H19O5N5SSmiles:
CO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(Nc3csc(CO)c3)ncnc21Aglycone:
OCc1cc(Nc2ncnc3c2N=C[N]3)cs1Sugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.44 |
| AlogP: | 0.39 | Num_rotatable_bonds: | 6 |
| MolWt: | 393.43 | Num_heavy_atoms: | 27 |
| TPSA: | 134.78 | NumAromaticRings: | 3 |
Unique Aglycone
AD35970
Formula: C10H8ON5S
Smiles:
OCc1cc(Nc2ncnc3c2N=C[N]3)cs1| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.1 |
| AlogP: | 1.68 | Num_rotatable_bonds: | 3 |
| MolWt: | 246.28 | Num_heavy_atoms: | 17 |
| TPSA: | 84.5 | NumAromaticRings: | 2 |
