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Popular Name: Galactaric acid Galactaric acid

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
ACHA4-2-E Neuronal Acetylcholine Receptor Protein Alpha-4 Subunit (cluster #2 Of 5), Eukaryotic Eukaryotes 530 0.63 Binding ≤ 10μM
ACHA6-3-E Neuronal Acetylcholine Receptor Subunit Alpha-6 (cluster #3 Of 4), Eukaryotic Eukaryotes 530 0.63 Binding ≤ 10μM
ACHA7-4-E Neuronal Acetylcholine Receptor Protein Alpha-7 Subunit (cluster #4 Of 6), Eukaryotic Eukaryotes 5770 0.52 Binding ≤ 10μM
ACHB3-3-E Neuronal Acetylcholine Receptor Subunit Beta-3 (cluster #3 Of 4), Eukaryotic Eukaryotes 530 0.63 Binding ≤ 10μM
ACHB4-7-E Neuronal Acetylcholine Receptor Subunit Beta-4 (cluster #7 Of 7), Eukaryotic Eukaryotes 24 0.76 Binding ≤ 10μM
Q8BGP7-2-E Neuronal Acetylcholine Receptor Protein Beta-2 Subunit (cluster #2 Of 2), Eukaryotic Eukaryotes 530 0.63 Binding ≤ 10μM

Physical Representations

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) -3.34 -8.52 -100.41 4 8 -2 161 208.122 5 ↓

Parameters Provided:

target.name = ACHA7-4-E
target.type = B10
page.format = summary
page.num = 1
filter.purchasability = purchasable

Structural Results Found: (before additional filtering)

SQL Query Was

SELECT DISTINCT(ci.sub_id_fk) AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id INNER JOIN activity AS ac ON ci.sub_id_fk=ac.sub_id_fk INNER JOIN target AS t ON ac.target_fk=t.target_id  WHERE c.free = 1 AND t.code LIKE 'ACHA7-4-E' AND t.atype_fk = 0 AND c.purchasable IN (1,2,4,5)    LIMIT 50

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//zinc12.docking.org/results/combination?target.name=ACHA7-4-E&target.type=B10&filter.purchasability=purchasable

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