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Analogs

44724742
44724742

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Popular Name: 5-methyl-3-[(3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)methyl]isoxazole 5-methyl-3-[(3-methyl-6,8-dihydr…

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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) -0.34 6.65 -58.49 1 6 1 61 234.283 2 ↓
Mid Mid (pH 6-8) -0.34 4.38 -18.97 0 6 0 60 233.275 2 ↓

Analogs

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Popular Name: 3-[(3-isopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)methyl]-5-methyl-isoxazole 3-[(3-isopropyl-6,8-dihydro-5H-[…

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) 0.72 7.68 -58.28 1 6 1 61 262.337 3 ↓
Mid Mid (pH 6-8) 0.72 5.43 -18.3 0 6 0 60 261.329 3 ↓

Parameters Provided:

ring.id = 339216
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 = 339216 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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