| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 26th, 2008 | 13 | Yes |
Popular Name: DNC014698 DNC014698
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) | -0.74 | 3.42 | -51.24 | 3 | 3 | 0 | 68 | 264.144 | 4 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| GABR1-1-E | GABA-B Receptor 1 (cluster #1 Of 3), Eukaryotic | Eukaryotes | 1860 | 0.62 | Binding ≤ 10μM |
| GABR2-1-E | GABA-B Receptor 2 (cluster #1 Of 3), Eukaryotic | Eukaryotes | 1860 | 0.62 | Binding ≤ 10μM |
| GBRB1-3-E | GABA Receptor Beta-1 Subunit (cluster #3 Of 6), Eukaryotic | Eukaryotes | 1860 | 0.62 | Binding ≤ 10μM |
| GBRB2-2-E | GABA Receptor Beta-2 Subunit (cluster #2 Of 7), Eukaryotic | Eukaryotes | 1860 | 0.62 | Binding ≤ 10μM |
| GBRB3-4-E | GABA Receptor Beta-3 Subunit (cluster #4 Of 6), Eukaryotic | Eukaryotes | 1860 | 0.62 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| GBRB1_RAT | P15431 | GABA Receptor Beta-1 Subunit, Rat | 1860 | 0.62 | Binding ≤ 10μM |
| GBRB2_RAT | P63138 | GABA Receptor Beta-2 Subunit, Rat | 1860 | 0.62 | Binding ≤ 10μM |
| GBRB3_RAT | P63079 | GABA Receptor Beta-3 Subunit, Rat | 1860 | 0.62 | Binding ≤ 10μM |
| GABR1_RAT | Q9Z0U4 | GABA-B Receptor 1, Rat | 1860 | 0.62 | Binding ≤ 10μM |
| GABR2_RAT | O88871 | GABA-B Receptor 2, Rat | 1860 | 0.62 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| GABA A receptor activation | |
| Ligand-gated ion channel transport |
