In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 5th, 2010 | 22 | No |
Popular Name: Hexadecyl(2-hydroxyethyl)dimethylammonium dihydrogen phosphate Hexadecyl(2-hydroxyethyl)dimethy…
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CAS Number: [85563-48-0]
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) | 3.23 | 13.71 | -28.69 | 1 | 2 | 1 | 20 | 314.578 | 17 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50425-6-O | Plasmodium Falciparum (cluster #6 Of 22), Other | Other | 810 | 0.39 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50425 | Z50425 | Plasmodium Falciparum | 810 | 0.39 | Functional ≤ 10μM |