In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2005 | 24 | Yes |
Popular Name: 4-[3-[bis(4-fluorophenyl)methoxy]propyl]-1H-imidazole 4-[3-[bis(4-fluorophenyl)methoxy…
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) | 4.10 | 11.81 | -39.11 | 2 | 3 | 1 | 39 | 329.37 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.10 | 11.34 | -11.05 | 1 | 3 | 0 | 38 | 328.362 | 7 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
HRH3-2-E | Histamine H3 Receptor (cluster #2 Of 2), Eukaryotic | Eukaryotes | 25 | 0.44 | Functional ≤ 10μM |
Z50425-12-O | Plasmodium Falciparum (cluster #12 Of 22), Other | Other | 631 | 0.36 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
HRH3_RAT | Q9QYN8 | Histamine H3 Receptor, Rat | 25.1188643 | 0.44 | Functional ≤ 10μM |
Z50425 | Z50425 | Plasmodium Falciparum | 1000 | 0.35 | Functional ≤ 10μM |
Description | Species |
---|---|
G alpha (i) signalling events | |
Histamine receptors |