In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 8th, 2009 | 32 | No |
Popular Name: triethyl-[2-[12-[2-(triethylammonio)ethoxy]dodecoxy]ethyl]ammonium triethyl-[2-[12-[2-(triethylammo…
None
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | -0.77 | 19.83 | -57.79 | 0 | 4 | 2 | 18 | 458.816 | 25 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50425-6-O | Plasmodium Falciparum (cluster #6 Of 22), Other | Other | 3 | 0.37 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50425 | Z50425 | Plasmodium Falciparum | 3.3 | 0.37 | Functional ≤ 10μM |