UCSF
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Analogs

31961501
31961501

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Popular Name: 2-(3,4-dimethoxyphenyl)-N-(6-pyrrolidin-1-yl-3-pyridyl)acetamide 2-(3,4-dimethoxyphenyl)-N-(6-pyr…

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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) 2.34 6.34 -17.62 1 6 0 64 341.411 6 ↓
Mid Mid (pH 6-8) 2.34 6.55 -45.03 2 6 1 65 342.419 6 ↓

Analogs

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Popular Name: 2-(2-hydroxyphenyl)-N-(6-pyrrolidin-1-yl-3-pyridyl)acetamide 2-(2-hydroxyphenyl)-N-(6-pyrroli…

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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) 2.64 5.39 -11.13 2 5 0 65 297.358 4 ↓
Mid Mid (pH 6-8) 2.64 5.84 -33.96 3 5 1 67 298.366 4 ↓

Parameters Provided:

ring.id = 109456
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 = 109456 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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