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Popular Name: N-[2-[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidyl]ethyl]-2-phenylsulfanyl-acetamide N-[2-[4-(2-oxo-3H-benzimidazol-1…

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
PLD1-1-E Phospholipase D1 (cluster #1 Of 2), Eukaryotic Eukaryotes 7400 0.25 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
PLD1_HUMAN Q13393 Phospholipase D1, Human 380 0.31 Binding ≤ 1μM
PLD1_HUMAN Q13393 Phospholipase D1, Human 380 0.31 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) 2.73 9.69 -55.33 3 6 1 71 411.551 7 ↓
Hi High (pH 8-9.5) 2.73 7.48 -19.84 2 6 0 70 410.543 7 ↓

Parameters Provided:

ring.id = 188647
filter.purchasability = annotated
page.format = targets
page.num = 1

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 hasring AS hr ON ci.sub_id_fk=hr.sub_id_fk INNER JOIN rings AS r ON hr.rings_fk=r.rings_id  WHERE r.rings_id = 188647 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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