| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2005 | 22 | No |
Popular Name: 1-Phenyl-3-(2-Chloro-8-Methyl-3-Quinolinyl)-2-Propen-1-One 1-Phenyl-3-(2-Chloro-8-Methyl-3-…
| 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) | 4.99 | 1.6 | -13.33 | 0 | 2 | 0 | 29 | 307.78 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 148-152o C | Indofine |
| SOLUBILITY | Soluble in Chloroform | Indofine |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| GRM1-1-E | Metabotropic Glutamate Receptor 1 (cluster #1 Of 5), Eukaryotic | Eukaryotes | 8500 | 0.32 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| GRM1_RAT | P23385 | Metabotropic Glutamate Receptor 1, Rat | 8500 | 0.32 | Functional ≤ 10μM |
