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Popular Name: 4-Imidazoleacetic acid hydrochloride 4-Imidazoleacetic acid hydrochlo…

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
GBRR2-3-E GABA Receptor Rho-2 Subunit (cluster #3 Of 3), Eukaryotic Eukaryotes 3000 0.86 Functional ≤ 10μM
Z104301-6-O GABA-A Receptor; Anion Channel (cluster #6 Of 8), Other Other 900 0.94 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) -0.41 3.83 -46.67 2 4 0 70 126.115 2 ↓
Mid Mid (pH 6-8) -0.41 3.31 -45.66 1 4 -1 69 125.107 2 ↓

Parameters Provided:

target.name = GBRR2-3-E
target.type = F10
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 'GBRR2-3-E' AND t.atype_fk = 5 AND c.purchasable IN (1,2,4,5)    LIMIT 50

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