Glycoside
GD125076
Name:
NoneFormula:
C17H19O6N5SSmiles:
[O-][NH+](O)c1ccc(CSc2ncnc3c2ncn3C2OC(CO)C(O)C2O)cc1Aglycone:
[O-][NH+](O)c1ccc(CSc2ncnc3c2N=C[N]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | -0.87 | Num_rotatable_bonds: | 6 |
| MolWt: | 421.44 | Num_heavy_atoms: | 29 |
| TPSA: | 161.25 | NumAromaticRings: | 3 |
Unique Aglycone
AD50575
Formula: C12H10O2N5S
Smiles:
[O-][NH+](O)c1ccc(CSc2ncnc3c2N=C[N]3)cc1| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 1.08 | Num_rotatable_bonds: | 4 |
| MolWt: | 288.31 | Num_heavy_atoms: | 20 |
| TPSA: | 99.97 | NumAromaticRings: | 2 |
