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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)-3-pyridyl]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) 0.48 4.61 -11.76 1 4 0 53 298.367 1 ↓

Analogs

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

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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) -0.08 5.32 -53.51 3 4 1 61 298.391 1 ↓
Mid Mid (pH 6-8) -0.08 4.92 -9.92 2 4 0 59 297.383 1 ↓

Analogs

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Popular Name: (5-amino-2-methyl-3-pyridyl)-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone (5-amino-2-methyl-3-pyridyl)-[(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) 1.51 5.09 -10.54 2 4 0 59 287.388 1 ↓
Lo Low (pH 4.5-6) 1.51 5.51 -37.88 3 4 1 60 288.396 1 ↓

Analogs

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Popular Name: (5-amino-2-methyl-3-pyridyl)-[(4R)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone (5-amino-2-methyl-3-pyridyl)-[(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) 1.51 4.91 -9.56 2 4 0 59 287.388 1 ↓
Lo Low (pH 4.5-6) 1.51 5.32 -36.85 3 4 1 60 288.396 1 ↓

Analogs

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Popular Name: (6-chloro-3-pyridyl)-(9-thia-4-azabicyclo[4.3.0]nona-7,10-dien-4-yl)methanone (6-chloro-3-pyridyl)-(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) 1.95 -1.24 -9.97 0 3 0 33 278.764 1 ↓

Analogs

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Popular Name: (5-bromo-3-pyridyl)-(9-thia-4-azabicyclo[4.3.0]nona-7,10-dien-4-yl)methanone (5-bromo-3-pyridyl)-(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) 1.89 -1.86 -7.52 0 3 0 33 323.215 1 ↓

Analogs

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Popular Name: (2-ethoxy-3-pyridyl)-(9-thia-4-azabicyclo[4.3.0]nona-7,10-dien-4-yl)methanone (2-ethoxy-3-pyridyl)-(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) 1.66 -1.6 -13.42 0 4 0 42 288.372 3 ↓

Analogs

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Popular Name: (2-methylsulfanyl-3-pyridyl)-(9-thia-4-azabicyclo[4.3.0]nona-7,10-dien-4-yl)methanone (2-methylsulfanyl-3-pyridyl)-(9-…

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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) 1.82 -1.12 -11.69 0 3 0 33 290.413 2 ↓

Analogs

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Popular Name: (6-methoxy-3-pyridyl)-(9-thia-4-azabicyclo[4.3.0]nona-7,10-dien-4-yl)methanone (6-methoxy-3-pyridyl)-(9-thia-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) 1.33 -1.85 -9.64 0 4 0 42 274.345 2 ↓

Analogs

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Popular Name: (2-hydroxy-3-pyridyl)-(9-thia-4-azabicyclo[4.3.0]nona-7,10-dien-4-yl)methanone (2-hydroxy-3-pyridyl)-(9-thia-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) 1.00 -3.88 -12.87 1 4 0 53 260.318 1 ↓

Analogs

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Popular Name: (2-sulfanyl-3-pyridyl)-(9-thia-4-azabicyclo[4.3.0]nona-7,10-dien-4-yl)methanone (2-sulfanyl-3-pyridyl)-(9-thia-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) 1.62 -2.85 -59.88 0 3 -1 33 275.378 1 ↓

Analogs

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Popular Name: [(4S)-4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-(6-methyl-3-pyridyl)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) 2.05 8.08 -10.24 0 3 0 33 286.4 2 ↓

Analogs

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Popular Name: [(4R)-4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-(6-methyl-3-pyridyl)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) 2.05 7.27 -7 0 3 0 33 286.4 2 ↓

Analogs

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Popular Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(6-fluoro-3-pyridyl)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) 1.44 5.86 -10.32 0 3 0 33 262.309 1 ↓

Analogs

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

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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) 2.00 6.25 -7.86 0 3 0 33 276.336 1 ↓

Analogs

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

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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) 2.00 6.35 -7.41 0 3 0 33 276.336 1 ↓

Analogs

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Popular Name: [(4R)-4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-(6-fluoro-3-pyridyl)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) 2.50 7.45 -10.1 0 3 0 33 290.363 2 ↓

Analogs

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Popular Name: [(4S)-4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-(6-fluoro-3-pyridyl)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) 2.50 7.39 -9.83 0 3 0 33 290.363 2 ↓

Analogs

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Popular Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(6-ethoxy-3-pyridyl)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) 1.71 5.35 -9.28 0 4 0 42 288.372 3 ↓

Analogs

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Popular Name: 5-(6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)pyridine-2-carboxamide 5-(6,7-dihydro-4H-thieno[3,2-c]p…

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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) -0.18 2.76 -10.64 2 5 0 76 287.344 2 ↓

Parameters Provided:

ring.id = 2624
filter.purchasability = annotated
page.format = targets
page.num = 1

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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 = 2624 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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