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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: 2,3-dihydro-1,4-benzodioxin-6-yl-(5-methyl-2-furyl)methanone 2,3-dihydro-1,4-benzodioxin-6-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) 2.38 6.12 -9.36 0 4 0 49 244.246 2 ↓

Analogs

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Popular Name: 2,3-dihydro-1,4-benzodioxin-6-yl-(5-nitro-2-furyl)methanone 2,3-dihydro-1,4-benzodioxin-6-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) 2.24 5.97 -9.14 0 7 0 95 275.216 3 ↓

Analogs

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Popular Name: 2,3-dihydro-1,4-benzodioxin-6-yl-(3-methyl-2-furyl)methanone 2,3-dihydro-1,4-benzodioxin-6-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) 2.54 5.98 -9.82 0 4 0 49 244.246 2 ↓

Analogs

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Popular Name: 2-[3,4-(Ethylenedioxy)benzoyl]furan 2-[3,4-(Ethylenedioxy)benzoyl]furan

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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) 2.16 5.3 -9.96 0 4 0 49 230.219 2 ↓

Analogs

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Popular Name: (5-bromo-2-furyl)-(2,3-dihydro-1,4-benzodioxin-6-yl)methanone (5-bromo-2-furyl)-(2,3-dihydro-1…

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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) 3.09 6.03 -6.72 0 4 0 49 309.115 2 ↓

Analogs

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Popular Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-(5-methyl-2-furyl)methanone (6-bromo-2,3-dihydro-1,4-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) 3.12 6.74 -8.4 0 4 0 49 323.142 2 ↓

Analogs

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Popular Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-(5-nitro-2-furyl)methanone (6-bromo-2,3-dihydro-1,4-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) 2.98 6.6 -8.34 0 7 0 95 354.112 3 ↓

Analogs

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Popular Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-(3-methyl-2-furyl)methanone (6-bromo-2,3-dihydro-1,4-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) 3.27 6.61 -8.72 0 4 0 49 323.142 2 ↓

Analogs

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Popular Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-(2-furyl)methanone (6-bromo-2,3-dihydro-1,4-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) 2.90 5.92 -8.75 0 4 0 49 309.115 2 ↓

Analogs

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Popular Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-(5-bromo-2-furyl)methanone (6-bromo-2,3-dihydro-1,4-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) 3.83 6.65 -6.33 0 4 0 49 388.011 2 ↓

Analogs

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Popular Name: (6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-(5-methyl-2-furyl)methanone (6-chloro-2,3-dihydro-1,4-benzod…

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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) 2.99 6.62 -8.62 0 4 0 49 278.691 2 ↓

Analogs

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Popular Name: (6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-(5-nitro-2-furyl)methanone (6-chloro-2,3-dihydro-1,4-benzod…

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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) 2.85 6.48 -8.44 0 7 0 95 309.661 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-(3-methyl-2-furyl)methanone (6-chloro-2,3-dihydro-1,4-benzod…

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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) 3.14 6.49 -8.96 0 4 0 49 278.691 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-(2-furyl)methanone (6-chloro-2,3-dihydro-1,4-benzod…

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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) 2.76 5.8 -9 0 4 0 49 264.664 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (5-bromo-2-furyl)-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methanone (5-bromo-2-furyl)-(6-chloro-2,3-…

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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) 3.70 6.53 -6.53 0 4 0 49 343.56 2 ↓

Parameters Provided:

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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 = 16114 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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