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Analogs

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Popular Name: 3-[[ethyl-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]amino]methyl]-7-methyl-1H-quinolin-2-one 3-[[ethyl-[(3-ethyl-1,2,4-oxadia…

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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) 1.75 6.56 -44 2 6 1 76 327.408 6 ↓
Mid Mid (pH 6-8) 1.75 4.8 -15.3 1 6 0 75 326.4 6 ↓

Analogs

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Popular Name: 6,7-dimethoxy-3-[[methyl-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]amino]methyl]-1H-quinolin-2-one 6,7-dimethoxy-3-[[methyl-[(3-met…

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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) -0.01 4.05 -51.24 2 8 1 95 345.379 6 ↓
Mid Mid (pH 6-8) -0.01 1.67 -15.87 1 8 0 93 344.371 6 ↓

Parameters Provided:

ring.id = 521527
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 = 521527 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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