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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

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Popular Name: 2-(4,6-dimethylbenzofuran-3-yl)-N-(3-imidazol-1-ylpropyl)acetamide 2-(4,6-dimethylbenzofuran-3-yl)-…

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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 9.58 -45.53 2 5 1 61 312.393 6 ↓
Mid Mid (pH 6-8) 2.23 9.07 -17.66 1 5 0 60 311.385 6 ↓

Analogs

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Popular Name: 2-(5-chloro-6-methyl-benzofuran-3-yl)-N-(3-imidazol-1-ylpropyl)acetamide 2-(5-chloro-6-methyl-benzofuran-…

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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) 2.46 9.62 -43.82 2 5 1 61 332.811 6 ↓
Mid Mid (pH 6-8) 2.46 9.1 -16.5 1 5 0 60 331.803 6 ↓

Analogs

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Popular Name: 2-(5-chloro-4,6-dimethyl-benzofuran-3-yl)-N-(3-imidazol-1-ylpropyl)acetamide 2-(5-chloro-4,6-dimethyl-benzofu…

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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) 2.84 9.9 -44.52 2 5 1 61 346.838 6 ↓
Mid Mid (pH 6-8) 2.84 9.39 -16.75 1 5 0 60 345.83 6 ↓

Analogs

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Popular Name: N-(3-imidazol-1-ylpropyl)-2-(6-methylbenzofuran-3-yl)acetamide N-(3-imidazol-1-ylpropyl)-2-(6-m…

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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) 1.85 9.19 -45.1 2 5 1 61 298.366 6 ↓
Mid Mid (pH 6-8) 1.85 8.68 -17.42 1 5 0 60 297.358 6 ↓

Analogs

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Popular Name: N-(3-imidazol-1-ylpropyl)-2-(5-methylbenzofuran-3-yl)acetamide N-(3-imidazol-1-ylpropyl)-2-(5-m…

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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) 1.85 9.2 -45.04 2 5 1 61 298.366 6 ↓
Mid Mid (pH 6-8) 1.85 8.68 -17.41 1 5 0 60 297.358 6 ↓

Analogs

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Popular Name: 2-(5-ethylbenzofuran-3-yl)-N-(3-imidazol-1-ylpropyl)acetamide 2-(5-ethylbenzofuran-3-yl)-N-(3-…

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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) 2.32 9.95 -44.68 2 5 1 61 312.393 7 ↓
Mid Mid (pH 6-8) 2.32 9.44 -17.04 1 5 0 60 311.385 7 ↓

Parameters Provided:

ring.id = 2781
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 = 2781 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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