Glycoside
GD016434
Name:
NoneFormula:
C17H14O5N3Cl3Smiles:
NC(=NO)c1c(Cl)n(C2O[C@H](CO)[C@H](O)[C@H]2O)c2cc(Cl)c(Cl)cc12Aglycone:
NC(=NO)c1c(Cl)[nH]c2cc(Cl)c(Cl)cc12Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.36 |
| AlogP: | 1.31 | Num_rotatable_bonds: | 3 |
| MolWt: | 410.64 | Num_heavy_atoms: | 25 |
| TPSA: | 133.46 | NumAromaticRings: | 2 |
Unique Aglycone
AD11833
Formula: C12H6ON3Cl3
Smiles:
NC(=NO)c1c(Cl)[nH]c2cc(Cl)c(Cl)cc12| HBA: | 4 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | 3.22 | Num_rotatable_bonds: | 1 |
| MolWt: | 278.53 | Num_heavy_atoms: | 16 |
| TPSA: | 74.4 | NumAromaticRings: | 2 |
