| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 23rd, 2010 | 29 | Yes |
| 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) | 4.06 | 9.97 | -45.25 | 4 | 5 | 1 | 68 | 397.518 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.06 | 8.07 | -51.27 | 4 | 5 | 1 | 69 | 397.518 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.06 | 9.9 | -77.27 | 5 | 5 | 2 | 70 | 398.526 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.06 | 10.22 | -166.12 | 6 | 5 | 3 | 71 | 399.534 | 6 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| HRH4-1-E | Histamine H4 Receptor (cluster #1 Of 4), Eukaryotic | Eukaryotes | 72 | 0.34 | Binding ≤ 10μM |
| HRH4-1-E | Histamine H4 Receptor (cluster #1 Of 2), Eukaryotic | Eukaryotes | 331 | 0.31 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| HRH4_HUMAN | Q9H3N8 | Histamine H4 Receptor, Human | 72 | 0.34 | Binding ≤ 1μM |
| HRH4_HUMAN | Q9H3N8 | Histamine H4 Receptor, Human | 72 | 0.34 | Binding ≤ 10μM |
| HRH4_HUMAN | Q9H3N8 | Histamine H4 Receptor, Human | 331 | 0.31 | Functional ≤ 10μM |
| Description | Species |
|---|---|
| G alpha (i) signalling events | |
| Histamine receptors |
