In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 17th, 2009 | 33 | No |
Popular Name: 16-(diethyl-(2-methoxyethyl)ammonio)hexadecyl-diethyl-(2-hydroxyethyl)ammonium 16-(diethyl-(2-methoxyethyl)ammo…
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) | -0.12 | 18.4 | -59.97 | 1 | 4 | 2 | 29 | 472.843 | 26 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50425-6-O | Plasmodium Falciparum (cluster #6 Of 22), Other | Other | 5 | 0.35 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50425 | Z50425 | Plasmodium Falciparum | 4.9 | 0.35 | Functional ≤ 10μM |