Glycoside
GD016436
Name:
NoneFormula:
C18H15O4N4Cl3SSmiles:
NC(S)=NN=Cc1c(Cl)n(C2O[C@H](CO)[C@H](O)[C@H]2O)c2cc(Cl)c(Cl)cc12Aglycone:
NC(S)=NN=Cc1c(Cl)[nH]c2cc(Cl)c(Cl)cc12Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | 1.79 | Num_rotatable_bonds: | 4 |
| MolWt: | 453.74 | Num_heavy_atoms: | 27 |
| TPSA: | 125.59 | NumAromaticRings: | 2 |
Unique Aglycone
AD11834
Formula: C13H7N4Cl3S
Smiles:
NC(S)=NN=Cc1c(Cl)[nH]c2cc(Cl)c(Cl)cc12| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 3.71 | Num_rotatable_bonds: | 2 |
| MolWt: | 321.62 | Num_heavy_atoms: | 18 |
| TPSA: | 66.53 | NumAromaticRings: | 2 |
