| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 8th, 2009 | 22 | Yes |
Popular Name: 2-methyl-2-phenyl-N-(quinoxalin-2-ylmethyl)propan-1-amine 2-methyl-2-phenyl-N-(quinoxalin-…
None
| 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) | 4.31 | 7.16 | -7.13 | 1 | 3 | 0 | 38 | 291.398 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.31 | 8.35 | -49.45 | 2 | 3 | 1 | 42 | 292.406 | 5 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| GRM1-2-E | Metabotropic Glutamate Receptor 1 (cluster #2 Of 5), Eukaryotic | Eukaryotes | 1210 | 0.38 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| GRM1_RAT | P23385 | Metabotropic Glutamate Receptor 1, Rat | 1210 | 0.38 | Functional ≤ 10μM |
