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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: (2Z)-6-[(6-chloro-4H-1,3-benzodioxin-8-yl)methoxy]-7-methyl-2-(2-thienylmethylene)benzofuran-3-one (2Z)-6-[(6-chloro-4H-1,3-benzodi…

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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) 5.53 11.24 -10.15 0 5 0 58 440.904 4 ↓

Analogs

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Popular Name: (2Z)-6-[(6-chloro-4H-1,3-benzodioxin-8-yl)methoxy]-7-methyl-2-[(3-methyl-2-thienyl)methylene]benzofu (2Z)-6-[(6-chloro-4H-1,3-benzodi…

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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) 5.91 11.85 -10.26 0 5 0 58 454.931 4 ↓

Analogs

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Popular Name: (2Z)-6-[(6-chloro-4H-1,3-benzodioxin-8-yl)methoxy]-4-methyl-2-(2-thienylmethylene)benzofuran-3-one (2Z)-6-[(6-chloro-4H-1,3-benzodi…

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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) 5.53 11.14 -9.9 0 5 0 58 440.904 4 ↓

Analogs

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Popular Name: (2Z)-6-[(6-chloro-4H-1,3-benzodioxin-8-yl)methoxy]-4-methyl-2-[(3-methyl-2-thienyl)methylene]benzofu (2Z)-6-[(6-chloro-4H-1,3-benzodi…

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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) 5.91 11.75 -10.02 0 5 0 58 454.931 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2Z)-6-[(6-chloro-4H-1,3-benzodioxin-8-yl)methoxy]-2-(2-thienylmethylene)benzofuran-3-one (2Z)-6-[(6-chloro-4H-1,3-benzodi…

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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) 5.16 10.49 -10.1 0 5 0 58 426.877 4 ↓

Analogs

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Popular Name: (2Z)-6-[(6-chloro-4H-1,3-benzodioxin-8-yl)methoxy]-2-[(3-methyl-2-thienyl)methylene]benzofuran-3-one (2Z)-6-[(6-chloro-4H-1,3-benzodi…

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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) 5.53 11.1 -10.22 0 5 0 58 440.904 4 ↓

Analogs

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Popular Name: (2Z)-6-[(6-bromo-4H-1,3-benzodioxin-8-yl)methoxy]-7-methyl-2-(2-thienylmethylene)benzofuran-3-one (2Z)-6-[(6-bromo-4H-1,3-benzodio…

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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) 5.66 11.34 -10.09 0 5 0 58 485.355 4 ↓

Analogs

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Popular Name: (2Z)-6-[(6-bromo-4H-1,3-benzodioxin-8-yl)methoxy]-7-methyl-2-[(3-methyl-2-thienyl)methylene]benzofur (2Z)-6-[(6-bromo-4H-1,3-benzodio…

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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) 6.04 11.95 -10.23 0 5 0 58 499.382 4 ↓

Analogs

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Popular Name: (2Z)-6-[(6-bromo-4H-1,3-benzodioxin-8-yl)methoxy]-4-methyl-2-(2-thienylmethylene)benzofuran-3-one (2Z)-6-[(6-bromo-4H-1,3-benzodio…

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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) 5.66 11.25 -9.87 0 5 0 58 485.355 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2Z)-6-[(6-bromo-4H-1,3-benzodioxin-8-yl)methoxy]-4-methyl-2-[(3-methyl-2-thienyl)methylene]benzofur (2Z)-6-[(6-bromo-4H-1,3-benzodio…

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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) 6.04 11.86 -9.98 0 5 0 58 499.382 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2Z)-6-[(6-bromo-4H-1,3-benzodioxin-8-yl)methoxy]-2-(2-thienylmethylene)benzofuran-3-one (2Z)-6-[(6-bromo-4H-1,3-benzodio…

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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) 5.29 10.6 -10.03 0 5 0 58 471.328 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2Z)-6-[(6-bromo-4H-1,3-benzodioxin-8-yl)methoxy]-2-[(3-methyl-2-thienyl)methylene]benzofuran-3-one (2Z)-6-[(6-bromo-4H-1,3-benzodio…

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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) 5.66 11.21 -10.17 0 5 0 58 485.355 4 ↓

Parameters Provided:

ring.id = 537083
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 = 537083 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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