UCSF
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44514022
44514022
26909292
26909292

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Popular Name: 2-[2-(4-amino-1-piperidyl)acetyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one 2-[2-(4-amino-1-piperidyl)acetyl…

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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) -0.35 5.99 -42.88 3 7 1 87 276.32 2 ↓
Hi High (pH 8-9.5) -0.35 4.14 -54.86 3 7 1 87 276.32 2 ↓
Lo Low (pH 4.5-6) -0.35 6.31 -112.32 4 7 2 88 277.328 2 ↓

Parameters Provided:

ring.id = 110005
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 = 110005 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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