| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 8th, 2009 | 24 | Yes |
Popular Name: 2-methyl-1-[12-(2-methylimidazol-1-yl)dodecyl]imidazole 2-methyl-1-[12-(2-methylimidazol…
| 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) | 4.43 | 15.65 | -63.9 | 2 | 4 | 2 | 38 | 332.536 | 13 | ↓ |
| Hi High (pH 8-9.5) | 4.43 | 14.78 | -12.79 | 0 | 4 | 0 | 36 | 330.52 | 13 | ↓ |
| Mid Mid (pH 6-8) | 4.43 | 15.23 | -35.19 | 1 | 4 | 1 | 37 | 331.528 | 13 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50425-16-O | Plasmodium Falciparum (cluster #16 Of 22), Other | Other | 270 | 0.38 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50425 | Z50425 | Plasmodium Falciparum | 270 | 0.38 | Functional ≤ 10μM |
