| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 9th, 2009 | 21 | Yes |
Popular Name: 7,7-dimethyl-2-[2-(2-pyridyl)ethynyl]-6,8-dihydroquinolin-5-one 7,7-dimethyl-2-[2-(2-pyridyl)eth…
| 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) | 2.43 | 8.4 | -11.84 | 0 | 3 | 0 | 43 | 276.339 | 0 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| GRM5-3-E | Metabotropic Glutamate Receptor 5 (cluster #3 Of 5), Eukaryotic | Eukaryotes | 2600 | 0.37 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| GRM5_RAT | P31424 | Metabotropic Glutamate Receptor 5, Rat | 210 | 0.45 | Binding ≤ 1μM |
| GRM5_RAT | P31424 | Metabotropic Glutamate Receptor 5, Rat | 210 | 0.45 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Class C/3 (Metabotropic glutamate/pheromone receptors) | |
| G alpha (q) signalling events |
