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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

37777698
37777698

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Popular Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-piperidyl]ethanone 1-[4-(2,3-dihydro-1,4-benzodioxi…

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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) 1.75 4.64 -13.12 1 5 0 51 276.336 2 ↓

Analogs

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Popular Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-prop-2-ynyl-piperidin-4-amine N-(2,3-dihydro-1,4-benzodioxin-6…

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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 6.86 -42.56 2 4 1 35 273.356 3 ↓
Mid Mid (pH 6-8) 2.55 4.58 -6.83 1 4 0 34 272.348 3 ↓

Analogs

37777670
37777670

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Popular Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidine-1-carboxamide 4-(2,3-dihydro-1,4-benzodioxin-6…

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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) 1.67 2.07 -13.55 3 6 0 77 277.324 2 ↓

Analogs

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Popular Name: 1-[4-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)amino]-1-piperidyl]ethanone 1-[4-[(6-bromo-2,3-dihydro-1,4-b…

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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) 2.49 5.36 -11.96 1 5 0 51 355.232 2 ↓

Analogs

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Popular Name: 4-[(7-bromo-2,3-dihydro-1,4-benzodioxin-6-yl)amino]piperidine-1-carboxamide 4-[(7-bromo-2,3-dihydro-1,4-benz…

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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) 2.40 2.79 -12.4 3 6 0 77 356.22 2 ↓

Analogs

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Popular Name: N7-(1-propyl-4-piperidyl)-2,3-dihydro-1,4-benzodioxine-6,7-diamine N7-(1-propyl-4-piperidyl)-2,3-di…

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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) 2.68 5.2 -40.64 4 5 1 61 292.403 4 ↓

Parameters Provided:

ring.id = 546833
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 = 546833 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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