| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 23rd, 2010 | 32 | 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) | 6.34 | 12.24 | -44.27 | 2 | 5 | 1 | 46 | 456.054 | 8 | ↓ |
| Hi High (pH 8-9.5) | 6.34 | 9.62 | -10.75 | 1 | 5 | 0 | 44 | 455.046 | 8 | ↓ |
| Mid Mid (pH 6-8) | 6.34 | 11.89 | -47.5 | 2 | 5 | 1 | 46 | 456.054 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 6.34 | 12.31 | -79.25 | 3 | 5 | 2 | 47 | 457.062 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 6.34 | 14.93 | -161.8 | 4 | 5 | 3 | 48 | 458.07 | 8 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| HRH4-1-E | Histamine H4 Receptor (cluster #1 Of 4), Eukaryotic | Eukaryotes | 609 | 0.27 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| HRH4_HUMAN | Q9H3N8 | Histamine H4 Receptor, Human | 609 | 0.27 | Binding ≤ 1μM |
| HRH4_HUMAN | Q9H3N8 | Histamine H4 Receptor, Human | 609 | 0.27 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| G alpha (i) signalling events | |
| Histamine receptors |
