| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2009 | 28 | Yes |
Popular Name: (4-benzylpiperazin-1-yl)-[1-(4-pyridylmethyl)-4-piperidyl]methanone (4-benzylpiperazin-1-yl)-[1-(4-p…
| 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) | 1.87 | 9.73 | -52.56 | 1 | 5 | 1 | 41 | 379.528 | 5 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| HRH3-2-E | Histamine H3 Receptor (cluster #2 Of 3), Eukaryotic | Eukaryotes | 28 | 0.38 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| HRH3_CAVPO | Q9JI35 | Histamine H3 Receptor, Guinea Pig | 28 | 0.38 | Binding ≤ 1μM |
| HRH3_CAVPO | Q9JI35 | Histamine H3 Receptor, Guinea Pig | 28 | 0.38 | Binding ≤ 10μM |
