UCSF
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Draw Identity 99% 90% 80% 70%

Popular Name: 5-(5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)pyridin-3-amine 5-(5,7-dimethyl-[1,2,4]triazolo[…

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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) 1.18 5.94 -19.62 2 6 0 82 240.27 1 ↓
Lo Low (pH 4.5-6) 1.18 6.4 -48.76 3 6 1 83 241.278 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-([1,2,4]triazolo[4,3-a]pyrimidin-3-yl)pyridin-3-amine 5-([1,2,4]triazolo[4,3-a]pyrimid…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.52 4.98 -20.89 2 6 0 82 212.216 1 ↓
Lo Low (pH 4.5-6) 0.52 5.44 -48.32 3 6 1 83 213.224 1 ↓

Parameters Provided:

ring.id = 315830
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 = 315830 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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