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Analogs

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Popular Name: N-(2,1,3-benzoxadiazol-4-ylmethyl)-N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-2-methoxy-ethanamin N-(2,1,3-benzoxadiazol-4-ylmethy…

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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) 2.23 5.34 -17.78 0 7 0 69 343.431 8 ↓
Lo Low (pH 4.5-6) 2.23 7.45 -52.74 1 7 1 70 344.439 8 ↓

Analogs

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Popular Name: N-(2,1,3-benzoxadiazol-4-ylmethyl)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]propan-1-amine N-(2,1,3-benzoxadiazol-4-ylmethy…

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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) 2.55 6.32 -15.54 0 6 0 60 299.378 6 ↓
Mid Mid (pH 6-8) 2.55 8.09 -52.43 1 6 1 61 300.386 6 ↓

Parameters Provided:

ring.id = 390756
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 = 390756 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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