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Popular Name: 545-55-1; APO; C19543; TEPA; Tris(1-aziridinyl)phosphine oxide 545-55-1; APO; C19543; TEPA; Tri…

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
DRD1-3-E Dopamine D1 Receptor (cluster #3 Of 4), Eukaryotic Eukaryotes 430 0.81 Binding ≤ 10μM
DRD2-24-E Dopamine D2 Receptor (cluster #24 Of 24), Eukaryotic Eukaryotes 220 0.85 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) -0.71 -5.66 -11 0 4 0 26 173.156 3 ↓

Parameters Provided:

target.name = DRD1-3-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 'DRD1-3-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=DRD1-3-E&target.type=B10&filter.purchasability=purchasable

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