| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 29th, 2007 | 15 | No |
Popular Name: 2-(2-nitrovinyl)quinoline 2-(2-nitrovinyl)quinoline
| 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) | 2.00 | 7.21 | -9.17 | 0 | 4 | 0 | 59 | 200.197 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.00 | 7.42 | -36.8 | 1 | 4 | 1 | 60 | 201.205 | 2 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50466-2-O | Trypanosoma Cruzi (cluster #2 Of 8), Other | Other | 1000 | 0.56 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50466 | Z50466 | Trypanosoma Cruzi | 1000 | 0.56 | Functional ≤ 10μM |
