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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: 7-methyl-N-propyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide 7-methyl-N-propyl-5,6-dihydro-4H…

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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) 2.62 5.14 -10 1 3 0 32 238.356 3 ↓

Analogs

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Popular Name: N-isopropyl-7-methyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide N-isopropyl-7-methyl-5,6-dihydro…

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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) 2.42 5.19 -10.19 1 3 0 32 238.356 2 ↓

Analogs

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Popular Name: 7-methyl-N-(3-pyridylmethyl)-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide 7-methyl-N-(3-pyridylmethyl)-5,6…

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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) 1.90 5.62 -10.87 1 4 0 45 287.388 3 ↓
Lo Low (pH 4.5-6) 1.90 6.09 -41.74 2 4 1 46 288.396 3 ↓

Analogs

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Popular Name: 7-methyl-N-(4-pyridylmethyl)-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide 7-methyl-N-(4-pyridylmethyl)-5,6…

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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) 1.85 5.64 -10.62 1 4 0 45 287.388 3 ↓
Lo Low (pH 4.5-6) 1.85 6.09 -42.64 2 4 1 46 288.396 3 ↓

Analogs

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Popular Name: N-benzyl-7-methyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide N-benzyl-7-methyl-5,6-dihydro-4H…

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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 7.4 -9.79 1 3 0 32 286.4 3 ↓

Analogs

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Popular Name: N-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide N-cyclohexyl-7-methyl-5,6-dihydr…

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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) 3.65 7.08 -10.1 1 3 0 32 278.421 2 ↓

Analogs

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Popular Name: N-cyclopentyl-7-methyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide N-cyclopentyl-7-methyl-5,6-dihyd…

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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 6.56 -10.01 1 3 0 32 264.394 2 ↓

Analogs

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Popular Name: N-cycloheptyl-7-methyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide N-cycloheptyl-7-methyl-5,6-dihyd…

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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) 4.15 7.46 -9.89 1 3 0 32 292.448 2 ↓

Analogs

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Popular Name: 7-methyl-N-(p-tolylmethyl)-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide 7-methyl-N-(p-tolylmethyl)-5,6-d…

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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) 3.59 8.06 -9.72 1 3 0 32 300.427 3 ↓

Analogs

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Popular Name: N-benzyl-N,7-dimethyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide N-benzyl-N,7-dimethyl-5,6-dihydr…

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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) 3.39 9.08 -12.91 0 3 0 24 300.427 3 ↓

Analogs

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Popular Name: (7-methyl-5,6-dihydro-4H-thieno[2,3-b]pyridin-2-yl)-pyrrolidin-1-yl-methanone (7-methyl-5,6-dihydro-4H-thieno[…

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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) 2.39 6.49 -12.14 0 3 0 24 250.367 1 ↓

Analogs

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Popular Name: 7-ethyl-N,N-dimethyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide 7-ethyl-N,N-dimethyl-5,6-dihydro…

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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) 2.36 6.04 -11.68 0 3 0 24 238.356 2 ↓

Analogs

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Popular Name: 7-ethyl-N-isopropyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide 7-ethyl-N-isopropyl-5,6-dihydro-…

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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) 2.79 6.18 -10.02 1 3 0 32 252.383 3 ↓

Analogs

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Popular Name: N-cyclohexyl-7-ethyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide N-cyclohexyl-7-ethyl-5,6-dihydro…

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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) 4.02 8.07 -9.91 1 3 0 32 292.448 3 ↓

Analogs

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Popular Name: N-cyclopentyl-7-ethyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide N-cyclopentyl-7-ethyl-5,6-dihydr…

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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) 3.52 7.54 -9.83 1 3 0 32 278.421 3 ↓

Analogs

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Popular Name: N-cyclopropyl-7-ethyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide N-cyclopropyl-7-ethyl-5,6-dihydr…

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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) 2.48 6.25 -9.77 1 3 0 32 250.367 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (7-ethyl-5,6-dihydro-4H-thieno[2,3-b]pyridin-2-yl)-pyrrolidin-1-yl-methanone (7-ethyl-5,6-dihydro-4H-thieno[2…

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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) 2.77 7.46 -12 0 3 0 24 264.394 2 ↓

Analogs

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Popular Name: (7-ethyl-5,6-dihydro-4H-thieno[2,3-b]pyridin-2-yl)-morpholino-methanone (7-ethyl-5,6-dihydro-4H-thieno[2…

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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) 2.21 5.69 -10.87 0 4 0 33 280.393 2 ↓

Parameters Provided:

ring.id = 368096
filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

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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 = 368096 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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