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Popular Name: N'-(2-cyclohexen-1-ylethyl)-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanediamide N'-(2-cyclohexen-1-ylethyl)-N-([…

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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) 2.47 9.26 -14.97 2 7 0 92 341.415 6 ↓
Hi High (pH 8-9.5) 2.48 8.82 -61.17 1 7 -1 95 340.407 7 ↓

Analogs

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Popular Name: N'-(2-cyclohexen-1-ylethyl)-N-(5-methoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)butanediamide N'-(2-cyclohexen-1-ylethyl)-N-(5…

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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) 2.65 8.34 -16.99 2 8 0 101 371.441 7 ↓
Hi High (pH 8-9.5) 2.66 7.79 -64.59 1 8 -1 104 370.433 8 ↓

Parameters Provided:

ring.id = 386418
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 = 386418 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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