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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: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-[5-(3-hydroxyprop-1-ynyl)-2-thienyl]methanone 6,7-dihydro-4H-thieno[3,2-c]pyri…

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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) 2.35 5.64 -10.84 1 3 0 41 303.408 1 ↓

Analogs

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Popular Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-[5-(4-hydroxybut-1-ynyl)-2-thienyl]methanone 6,7-dihydro-4H-thieno[3,2-c]pyri…

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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 6.4 -8.97 1 3 0 41 317.435 2 ↓

Analogs

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Popular Name: (4-amino-5-methyl-2-thienyl)-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone (4-amino-5-methyl-2-thienyl)-[(4…

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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) 2.73 6.04 -8.13 2 3 0 46 292.429 1 ↓
Lo Low (pH 4.5-6) 2.73 5.84 -46.37 3 3 1 48 293.437 1 ↓

Analogs

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Popular Name: (4-amino-5-methyl-2-thienyl)-[(4R)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone (4-amino-5-methyl-2-thienyl)-[(4…

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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) 2.73 5.88 -7.63 2 3 0 46 292.429 1 ↓
Lo Low (pH 4.5-6) 2.73 5.66 -46.63 3 3 1 48 293.437 1 ↓

Analogs

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Popular Name: (3-amino-2-thienyl)-[(4R)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone (3-amino-2-thienyl)-[(4R)-4-meth…

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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) 2.51 5.2 -7.89 2 3 0 46 278.402 1 ↓
Lo Low (pH 4.5-6) 2.51 5.12 -37.73 3 3 1 48 279.41 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3-amino-2-thienyl)-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone (3-amino-2-thienyl)-[(4S)-4-meth…

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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) 2.51 5.3 -8.54 2 3 0 46 278.402 1 ↓
Lo Low (pH 4.5-6) 2.51 5.16 -36.17 3 3 1 48 279.41 1 ↓

Analogs

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Popular Name: 5-[(4R)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl]thiophene-2-carboxylic 5-[(4R)-4-methyl-6,7-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) 2.91 7.98 -44.54 0 4 -1 60 306.388 2 ↓

Analogs

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Popular Name: 5-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl]thiophene-2-carboxylic 5-[(4S)-4-methyl-6,7-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) 2.91 8.04 -45.7 0 4 -1 60 306.388 2 ↓

Analogs

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Popular Name: (4,5-dibromo-2-thienyl)-(9-thia-4-azabicyclo[4.3.0]nona-7,10-dien-4-yl)methanone (4,5-dibromo-2-thienyl)-(9-thia-…

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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) 4.21 -2.42 -6.7 0 2 0 20 407.152 1 ↓

Analogs

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Popular Name: (5-bromo-2-thienyl)-(9-thia-4-azabicyclo[4.3.0]nona-7,10-dien-4-yl)methanone (5-bromo-2-thienyl)-(9-thia-4-az…

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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) 3.47 -1.64 -6.28 0 2 0 20 328.256 1 ↓

Analogs

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Popular Name: (5-methyl-2-thienyl)-(9-thia-4-azabicyclo[4.3.0]nona-7,10-dien-4-yl)methanone (5-methyl-2-thienyl)-(9-thia-4-a…

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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 -0.63 -8.36 0 2 0 20 263.387 1 ↓

Analogs

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Popular Name: [(4R)-4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-(2-thienyl)methanone [(4R)-4-ethyl-6,7-dihydro-4H-thi…

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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) 3.60 7.97 -8.19 0 2 0 20 277.414 2 ↓

Analogs

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Popular Name: [(4S)-4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-(2-thienyl)methanone [(4S)-4-ethyl-6,7-dihydro-4H-thi…

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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) 3.60 7.76 -8.46 0 2 0 20 277.414 2 ↓

Parameters Provided:

ring.id = 7647
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 = 7647 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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