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Popular Name: 2-(5-heptyl-1,3-dioxan-2-yl)thieno[2,3-b]thiophene-5-carbonitrile 2-(5-heptyl-1,3-dioxan-2-yl)thie…

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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) 6.50 11.3 -5.38 0 3 0 42 349.521 7 ↓

Analogs

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Popular Name: 5-nonyl-2-(5-octylthieno[2,3-b]thiophen-2-yl)-1,3-dioxane 5-nonyl-2-(5-octylthieno[2,3-b]t…

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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) 9.48 18.56 -5.48 0 2 0 18 464.781 16 ↓

Analogs

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Popular Name: 2-(5-ethyl-1,3-dioxan-2-yl)thieno[2,3-b]thiophene-5-carbonitrile 2-(5-ethyl-1,3-dioxan-2-yl)thien…

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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) 3.92 7.41 -5.53 0 3 0 42 279.386 2 ↓

Analogs

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Popular Name: 2-(2-octylthieno[2,3-b]thiophen-5-yl)-5-propyl-1,3-dioxane 2-(2-octylthieno[2,3-b]thiophen-…

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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) 8.31 13.83 -5.37 0 2 0 18 380.619 10 ↓

Analogs

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Popular Name: 2-(5-propyl-1,3-dioxan-2-yl)thieno[2,3-b]thiophene-5-carbonitrile 2-(5-propyl-1,3-dioxan-2-yl)thie…

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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) 4.48 8.12 -5.36 0 3 0 42 293.413 3 ↓

Analogs

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Popular Name: 5-butyl-2-(5-propylthieno[2,3-b]thiophen-2-yl)-1,3-dioxane 5-butyl-2-(5-propylthieno[2,3-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) 6.29 10.7 -5.41 0 2 0 18 324.511 6 ↓

Analogs

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Popular Name: 5-butyl-2-(2-pentylthieno[2,3-b]thiophen-5-yl)-1,3-dioxane 5-butyl-2-(2-pentylthieno[2,3-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) 7.35 12.31 -5.69 0 2 0 18 352.565 8 ↓

Analogs

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Popular Name: 2-(5-nonyl-1,3-dioxan-2-yl)thieno[2,3-b]thiophene-5-carbonitrile 2-(5-nonyl-1,3-dioxan-2-yl)thien…

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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) 7.51 12.87 -5.36 0 3 0 42 377.575 9 ↓

Analogs

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Popular Name: 2-(5-pentyl-1,3-dioxan-2-yl)thieno[2,3-b]thiophene-5-carbonitrile 2-(5-pentyl-1,3-dioxan-2-yl)thie…

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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) 5.49 9.74 -5.45 0 3 0 42 321.467 5 ↓

Analogs

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Popular Name: 2-(5-butyl-1,3-dioxan-2-yl)thieno[2,3-b]thiophene-5-carbonitrile 2-(5-butyl-1,3-dioxan-2-yl)thien…

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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) 4.99 8.96 -5.5 0 3 0 42 307.44 4 ↓

Analogs

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Popular Name: 5-heptyl-2-(2-octylthieno[2,3-b]thiophen-5-yl)-1,3-dioxane 5-heptyl-2-(2-octylthieno[2,3-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) 9.22 17 -5.49 0 2 0 18 436.727 14 ↓

Analogs

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Popular Name: 5-propyl-2-(2-propylthieno[2,3-b]thiophen-5-yl)-1,3-dioxane 5-propyl-2-(2-propylthieno[2,3-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) 5.78 9.92 -5.41 0 2 0 18 310.484 5 ↓

Analogs

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Popular Name: 5-nonyl-2-(5-pentylthieno[2,3-b]thiophen-2-yl)-1,3-dioxane 5-nonyl-2-(5-pentylthieno[2,3-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) 9.06 16.22 -5.52 0 2 0 18 422.7 13 ↓

Analogs

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Popular Name: 5-ethyl-2-(2-propylthieno[2,3-b]thiophen-5-yl)-1,3-dioxane 5-ethyl-2-(2-propylthieno[2,3-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) 5.22 9.2 -5.68 0 2 0 18 296.457 4 ↓

Analogs

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Popular Name: 2-(2-octylthieno[2,3-b]thiophen-5-yl)-5-pentyl-1,3-dioxane 2-(2-octylthieno[2,3-b]thiophen-…

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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) 8.86 15.44 -5.64 0 2 0 18 408.673 12 ↓

Analogs

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Popular Name: 5-ethyl-2-(2-pentylthieno[2,3-b]thiophen-5-yl)-1,3-dioxane 5-ethyl-2-(2-pentylthieno[2,3-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) 6.29 10.77 -5.67 0 2 0 18 324.511 6 ↓

Analogs

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Popular Name: 5-nonyl-2-(5-propylthieno[2,3-b]thiophen-2-yl)-1,3-dioxane 5-nonyl-2-(5-propylthieno[2,3-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) 8.60 14.61 -5.35 0 2 0 18 394.646 11 ↓

Analogs

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Popular Name: 5-pentyl-2-(5-propylthieno[2,3-b]thiophen-2-yl)-1,3-dioxane 5-pentyl-2-(5-propylthieno[2,3-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) 6.79 11.53 -5.67 0 2 0 18 338.538 7 ↓

Analogs

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Popular Name: 5-heptyl-2-(5-pentylthieno[2,3-b]thiophen-2-yl)-1,3-dioxane 5-heptyl-2-(5-pentylthieno[2,3-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) 8.62 14.66 -5.53 0 2 0 18 394.646 11 ↓

Analogs

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Popular Name: 5-ethyl-2-(2-octylthieno[2,3-b]thiophen-5-yl)-1,3-dioxane 5-ethyl-2-(2-octylthieno[2,3-b]t…

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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) 7.80 13.11 -5.69 0 2 0 18 366.592 9 ↓

Analogs

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Popular Name: 5-heptyl-2-(5-propylthieno[2,3-b]thiophen-2-yl)-1,3-dioxane 5-heptyl-2-(5-propylthieno[2,3-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) 7.80 13.05 -5.35 0 2 0 18 366.592 9 ↓

Analogs

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Popular Name: 5-butyl-2-(2-octylthieno[2,3-b]thiophen-5-yl)-1,3-dioxane 5-butyl-2-(2-octylthieno[2,3-b]t…

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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) 8.62 14.66 -5.63 0 2 0 18 394.646 11 ↓

Parameters Provided:

ring.id = 195133
filter.purchasability = annotated
page.format = targets
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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 = 195133 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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