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Popular Name: 5-tert-butyl-3-[[methyl-[(2-methylthiazol-4-yl)methyl]amino]methyl]-1,3,4-oxadiazole-2-thione 5-tert-butyl-3-[[methyl-[(2-meth…

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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) 1.99 6.34 -37.32 1 5 1 48 313.472 5 ↓
Mid Mid (pH 6-8) 1.99 3.7 -9.69 0 5 0 47 312.464 5 ↓

Analogs

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Popular Name: 3-[[methyl-[(2-methylthiazol-4-yl)methyl]amino]methyl]-5-(methylsulfanylmethyl)-1,3,4-oxadiazole-2-t 3-[[methyl-[(2-methylthiazol-4-y…

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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) 0.78 5.71 -37.9 1 5 1 48 317.485 6 ↓
Mid Mid (pH 6-8) 0.78 3.06 -11.05 0 5 0 47 316.477 6 ↓

Parameters Provided:

ring.id = 560163
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 = 560163 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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