UCSF
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Popular Name: N-[[(2R)-1,4-dioxan-2-yl]methyl]-2-methyl-6-(4-piperidyl)pyrimidin-4-amine N-[[(2R)-1,4-dioxan-2-yl]methyl]…

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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) -0.03 3.55 -50.1 3 6 1 73 293.391 4 ↓
Mid Mid (pH 6-8) -0.03 4.17 -96.15 4 6 2 74 294.399 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-2-methyl-6-(4-piperidyl)pyrimidin-4-amine N-[[(2S)-1,4-dioxan-2-yl]methyl]…

Find On: PubMed — Wikipedia — Google

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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) -0.03 3.6 -50.02 3 6 1 73 293.391 4 ↓
Mid Mid (pH 6-8) -0.03 4.21 -96.01 4 6 2 74 294.399 4 ↓

Parameters Provided:

ring.id = 590355
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 = 590355 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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