| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 11th, 2006 | 22 | No |
Popular Name: 1-(2,4-dichlorophenyl)-3-(2,4-dimethoxyphenyl)-prop-2-en-1-one 1-(2,4-dichlorophenyl)-3-(2,4-di…
| 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) | 4.96 | 2.13 | -11.69 | 0 | 3 | 0 | 35 | 337.202 | 5 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50425-11-O | Plasmodium Falciparum (cluster #11 Of 22), Other | Other | 3800 | 0.34 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50425 | Z50425 | Plasmodium Falciparum | 3400 | 0.35 | Functional ≤ 10μM |
