| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 17th, 2009 | 23 | Yes |
Popular Name: 1-(4-fluorophenyl)-2-[4-(4-fluorophenyl)-1-piperidyl]ethanone 1-(4-fluorophenyl)-2-[4-(4-fluor…
| 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) | 4.29 | 11.99 | -51.83 | 1 | 2 | 1 | 22 | 316.371 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.29 | 9.77 | -8.43 | 0 | 2 | 0 | 20 | 315.363 | 4 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50597-12-O | Rattus Norvegicus (cluster #12 Of 12), Other | Other | 4330 | 0.33 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50597 | Z50597 | Rattus Norvegicus | 4330 | 0.33 | Functional ≤ 10μM |
