| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 10th, 2009 | 39 | Yes |
Popular Name: 5-methyl-2-[4-[5-[4-(5-methyl-1H-benzimidazol-2-yl)phenoxy]pentoxy]phenyl]-1H-benzimidazole 5-methyl-2-[4-[5-[4-(5-methyl-1H…
| 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) | 8.58 | 16.16 | -22.63 | 2 | 6 | 0 | 76 | 516.645 | 10 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50422-3-O | Entamoeba Histolytica (cluster #3 Of 5), Other | Other | 153 | 0.24 | Functional ≤ 10μM |
| Z50461-2-O | Leishmania Mexicana (cluster #2 Of 3), Other | Other | 368 | 0.23 | Functional ≤ 10μM |
| Z50467-2-O | Trichomonas Vaginalis (cluster #2 Of 3), Other | Other | 4161 | 0.19 | Functional ≤ 10μM |
| Z50468-2-O | Giardia Intestinalis (cluster #2 Of 4), Other | Other | 4888 | 0.19 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50422 | Z50422 | Entamoeba Histolytica | 153 | 0.24 | Functional ≤ 10μM |
| Z50468 | Z50468 | Giardia Intestinalis | 4888 | 0.19 | Functional ≤ 10μM |
| Z50461 | Z50461 | Leishmania Mexicana | 368 | 0.23 | Functional ≤ 10μM |
| Z50467 | Z50467 | Trichomonas Vaginalis | 4161 | 0.19 | Functional ≤ 10μM |
