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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: 3-amino-1-(3-phenylpropyl)pyridin-2-one 3-amino-1-(3-phenylpropyl)pyridi…

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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) 2.08 6.74 -11.12 2 3 0 48 228.295 4 ↓

Analogs

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Popular Name: (2S)-2-(3-methoxy-2-oxo-1-pyridyl)-4-phenyl-butanoic (2S)-2-(3-methoxy-2-oxo-1-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) 1.89 9.49 -52.2 0 5 -1 71 286.307 6 ↓

Analogs

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Popular Name: (2R)-2-(3-methoxy-2-oxo-1-pyridyl)-4-phenyl-butanoic (2R)-2-(3-methoxy-2-oxo-1-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) 1.89 9.56 -52.09 0 5 -1 71 286.307 6 ↓

Analogs

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Popular Name: (2S)-2-(2-methyl-6-oxo-1-pyridyl)-4-phenyl-butanoic (2S)-2-(2-methyl-6-oxo-1-pyridyl…

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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) 2.04 10.73 -61.87 0 4 -1 62 270.308 5 ↓

Analogs

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Popular Name: (2R)-2-(2-methyl-6-oxo-1-pyridyl)-4-phenyl-butanoic (2R)-2-(2-methyl-6-oxo-1-pyridyl…

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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) 2.04 10.73 -60.56 0 4 -1 62 270.308 5 ↓

Analogs

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Popular Name: (2S)-2-(2-methyl-6-oxo-1-pyridyl)-4-(p-tolyl)butanoic (2S)-2-(2-methyl-6-oxo-1-pyridyl…

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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) 2.49 11.41 -60.53 0 4 -1 62 284.335 5 ↓

Analogs

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Popular Name: (2R)-2-(2-methyl-6-oxo-1-pyridyl)-4-(p-tolyl)butanoic (2R)-2-(2-methyl-6-oxo-1-pyridyl…

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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) 2.49 11.39 -61.4 0 4 -1 62 284.335 5 ↓

Analogs

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Popular Name: (2S)-2-(4-methyl-2-oxo-1-pyridyl)-4-phenyl-butanoic (2S)-2-(4-methyl-2-oxo-1-pyridyl…

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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) 2.28 10.99 -61.49 0 4 -1 62 270.308 5 ↓

Analogs

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Popular Name: (2R)-2-(4-methyl-2-oxo-1-pyridyl)-4-phenyl-butanoic (2R)-2-(4-methyl-2-oxo-1-pyridyl…

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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) 2.28 11 -60.48 0 4 -1 62 270.308 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-(4-methyl-2-oxo-1-pyridyl)-4-(p-tolyl)butanoic (2S)-2-(4-methyl-2-oxo-1-pyridyl…

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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 10.66 -50.17 0 4 -1 62 284.335 5 ↓

Analogs

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Popular Name: (2R)-2-(4-methyl-2-oxo-1-pyridyl)-4-(p-tolyl)butanoic (2R)-2-(4-methyl-2-oxo-1-pyridyl…

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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 10.73 -50.05 0 4 -1 62 284.335 5 ↓

Analogs

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Popular Name: 5-bromo-1-(3-phenylpropyl)pyridin-2-one 5-bromo-1-(3-phenylpropyl)pyridi…

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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) 3.73 9.39 -9.8 0 2 0 22 292.176 4 ↓

Analogs

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Popular Name: (2S)-2-(5-methyl-2-oxo-1-pyridyl)-4-phenyl-butanoic (2S)-2-(5-methyl-2-oxo-1-pyridyl…

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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) 2.60 10.97 -60.11 0 4 -1 62 270.308 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-(5-methyl-2-oxo-1-pyridyl)-4-phenyl-butanoic (2R)-2-(5-methyl-2-oxo-1-pyridyl…

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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) 2.60 10.98 -59.21 0 4 -1 62 270.308 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-(5-methyl-2-oxo-1-pyridyl)-4-(p-tolyl)butanoic (2S)-2-(5-methyl-2-oxo-1-pyridyl…

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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) 3.05 11.66 -59.47 0 4 -1 62 284.335 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-(5-methyl-2-oxo-1-pyridyl)-4-(p-tolyl)butanoic (2R)-2-(5-methyl-2-oxo-1-pyridyl…

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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) 3.05 11.68 -60.04 0 4 -1 62 284.335 5 ↓

Analogs

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Popular Name: (2S)-2-(5-chloro-2-oxo-1-pyridyl)-4-phenyl-butanoic (2S)-2-(5-chloro-2-oxo-1-pyridyl…

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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) 2.83 9.82 -45.35 0 4 -1 62 290.726 5 ↓

Analogs

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Popular Name: (2R)-2-(5-chloro-2-oxo-1-pyridyl)-4-phenyl-butanoic (2R)-2-(5-chloro-2-oxo-1-pyridyl…

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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) 2.83 9.89 -45.22 0 4 -1 62 290.726 5 ↓

Analogs

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Popular Name: (2S)-2-(5-fluoro-2-oxo-1-pyridyl)-4-phenyl-butanoic (2S)-2-(5-fluoro-2-oxo-1-pyridyl…

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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) 2.32 9.46 -45.6 0 4 -1 62 274.271 5 ↓

Analogs

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Popular Name: (2R)-2-(5-fluoro-2-oxo-1-pyridyl)-4-phenyl-butanoic (2R)-2-(5-fluoro-2-oxo-1-pyridyl…

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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) 2.32 9.39 -45.63 0 4 -1 62 274.271 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-(5-fluoro-2-oxo-1-pyridyl)-4-(p-tolyl)butanoic (2S)-2-(5-fluoro-2-oxo-1-pyridyl…

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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 10.14 -45.75 0 4 -1 62 288.298 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-(5-fluoro-2-oxo-1-pyridyl)-4-(p-tolyl)butanoic (2R)-2-(5-fluoro-2-oxo-1-pyridyl…

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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 10.07 -45.83 0 4 -1 62 288.298 5 ↓

Analogs

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Popular Name: (2S)-2-(3-methyl-2-oxo-1-pyridyl)-4-phenyl-butanoic (2S)-2-(3-methyl-2-oxo-1-pyridyl…

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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) 2.28 10 -50.2 0 4 -1 62 270.308 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-(3-methyl-2-oxo-1-pyridyl)-4-phenyl-butanoic (2R)-2-(3-methyl-2-oxo-1-pyridyl…

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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) 2.28 10.07 -50.11 0 4 -1 62 270.308 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-(3-methyl-2-oxo-1-pyridyl)-4-(p-tolyl)butanoic (2S)-2-(3-methyl-2-oxo-1-pyridyl…

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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 10.75 -50.38 0 4 -1 62 284.335 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-(3-methyl-2-oxo-1-pyridyl)-4-(p-tolyl)butanoic (2R)-2-(3-methyl-2-oxo-1-pyridyl…

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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 10.68 -50.39 0 4 -1 62 284.335 5 ↓

Analogs

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Popular Name: 6-methyl-5-nitro-1-(3-phenylpropyl)pyridin-2-one 6-methyl-5-nitro-1-(3-phenylprop…

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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) 3.10 9.68 -10.59 0 5 0 68 272.304 5 ↓

Analogs

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Popular Name: 6-methyl-2-oxo-1-(3-phenylpropyl)pyridine-3-carboxylic 6-methyl-2-oxo-1-(3-phenylpropyl…

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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) 2.33 10.61 -73.11 0 4 -1 62 270.308 5 ↓

Parameters Provided:

ring.id = 10465
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 = 10465 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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