In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 16th, 2010 | 19 | Yes |
Popular Name: DNC011247 DNC011247
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) | 4.10 | 7.58 | -9.03 | 1 | 4 | 0 | 55 | 366.158 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.10 | 8.03 | -36.56 | 2 | 4 | 1 | 56 | 367.166 | 3 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
GBRA1-6-E | GABA Receptor Alpha-1 Subunit (cluster #6 Of 8), Eukaryotic | Eukaryotes | 5 | 0.61 | Binding ≤ 10μM |
GBRA2-5-E | GABA Receptor Alpha-2 Subunit (cluster #5 Of 8), Eukaryotic | Eukaryotes | 31 | 0.55 | Binding ≤ 10μM |
GBRA3-7-E | GABA Receptor Alpha-3 Subunit (cluster #7 Of 8), Eukaryotic | Eukaryotes | 34 | 0.55 | Binding ≤ 10μM |
GBRA4-1-E | GABA Receptor Alpha-4 Subunit (cluster #1 Of 7), Eukaryotic | Eukaryotes | 1000 | 0.44 | Binding ≤ 10μM |
GBRA5-3-E | GABA Receptor Alpha-5 Subunit (cluster #3 Of 8), Eukaryotic | Eukaryotes | 286 | 0.48 | Binding ≤ 10μM |
GBRA6-8-E | GABA Receptor Alpha-6 Subunit (cluster #8 Of 8), Eukaryotic | Eukaryotes | 1000 | 0.44 | Binding ≤ 10μM |
GBRB3-2-E | GABA Receptor Beta-3 Subunit (cluster #2 Of 6), Eukaryotic | Eukaryotes | 5 | 0.61 | Binding ≤ 10μM |
GBRG2-2-E | GABA Receptor Gamma-2 Subunit (cluster #2 Of 7), Eukaryotic | Eukaryotes | 5 | 0.61 | Binding ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
GBRA1_HUMAN | P14867 | GABA Receptor Alpha-1 Subunit, Human | 4.8 | 0.61 | Binding ≤ 1μM |
GBRA2_HUMAN | P47869 | GABA Receptor Alpha-2 Subunit, Human | 31 | 0.55 | Binding ≤ 1μM |
GBRA3_HUMAN | P34903 | GABA Receptor Alpha-3 Subunit, Human | 34 | 0.55 | Binding ≤ 1μM |
GBRA4_HUMAN | P48169 | GABA Receptor Alpha-4 Subunit, Human | 1000 | 0.44 | Binding ≤ 1μM |
GBRA5_HUMAN | P31644 | GABA Receptor Alpha-5 Subunit, Human | 286 | 0.48 | Binding ≤ 1μM |
GBRA6_HUMAN | Q16445 | GABA Receptor Alpha-6 Subunit, Human | 1000 | 0.44 | Binding ≤ 1μM |
GBRB3_HUMAN | P28472 | GABA Receptor Beta-3 Subunit, Human | 1000 | 0.44 | Binding ≤ 1μM |
GBRG2_HUMAN | P18507 | GABA Receptor Gamma-2 Subunit, Human | 1000 | 0.44 | Binding ≤ 1μM |
GBRA1_HUMAN | P14867 | GABA Receptor Alpha-1 Subunit, Human | 4.8 | 0.61 | Binding ≤ 10μM |
GBRA2_HUMAN | P47869 | GABA Receptor Alpha-2 Subunit, Human | 31 | 0.55 | Binding ≤ 10μM |
GBRA3_HUMAN | P34903 | GABA Receptor Alpha-3 Subunit, Human | 34 | 0.55 | Binding ≤ 10μM |
GBRA4_HUMAN | P48169 | GABA Receptor Alpha-4 Subunit, Human | 1000 | 0.44 | Binding ≤ 10μM |
GBRA5_HUMAN | P31644 | GABA Receptor Alpha-5 Subunit, Human | 286 | 0.48 | Binding ≤ 10μM |
GBRA6_HUMAN | Q16445 | GABA Receptor Alpha-6 Subunit, Human | 1000 | 0.44 | Binding ≤ 10μM |
GBRB3_HUMAN | P28472 | GABA Receptor Beta-3 Subunit, Human | 1000 | 0.44 | Binding ≤ 10μM |
GBRG2_HUMAN | P18507 | GABA Receptor Gamma-2 Subunit, Human | 1000 | 0.44 | Binding ≤ 10μM |
Description | Species |
---|---|
GABA A receptor activation | |
Ligand-gated ion channel transport |