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Popular Name: 1-[2-(4-propylphenoxy)acetyl]piperidin-4-one 1-[2-(4-propylphenoxy)acetyl]pip…

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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) 2.22 8.71 -14.08 0 4 0 47 275.348 5 ↓

Analogs

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Popular Name: 1-(2-phenoxyacetyl)piperidin-4-one 1-(2-phenoxyacetyl)piperidin-4-one

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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) 0.92 6.52 -14.66 0 4 0 47 233.267 3 ↓

Analogs

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Popular Name: 1-[2-(2,3-difluorophenoxy)acetyl]piperidin-4-one 1-[2-(2,3-difluorophenoxy)acetyl…

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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) 1.15 6.61 -22.11 0 4 0 47 269.247 3 ↓

Analogs

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Popular Name: 1-[2-(3,5-difluorophenoxy)acetyl]piperidin-4-one 1-[2-(3,5-difluorophenoxy)acetyl…

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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) 1.17 6.62 -14.01 0 4 0 47 269.247 3 ↓

Analogs

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Popular Name: 1-[2-[3-(trifluoromethyl)phenoxy]acetyl]piperidin-4-one 1-[2-[3-(trifluoromethyl)phenoxy…

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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) 1.79 7.5 -17.21 0 4 0 47 301.264 4 ↓

Analogs

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Popular Name: 4-[2-oxo-2-(4-oxo-1-piperidyl)ethoxy]benzonitrile 4-[2-oxo-2-(4-oxo-1-piperidyl)et…

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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) 0.67 6.89 -17.9 0 5 0 70 258.277 3 ↓

Analogs

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Popular Name: 2-[2-oxo-2-(4-oxo-1-piperidyl)ethoxy]benzonitrile 2-[2-oxo-2-(4-oxo-1-piperidyl)et…

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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) 0.62 6.89 -22.9 0 5 0 70 258.277 3 ↓

Analogs

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Popular Name: 1-[2-(2-bromo-4-chloro-phenoxy)acetyl]piperidin-4-one 1-[2-(2-bromo-4-chloro-phenoxy)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) 2.33 7.64 -16.38 0 4 0 47 346.608 3 ↓

Analogs

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Popular Name: 1-[2-(2-bromo-4-fluoro-phenoxy)acetyl]piperidin-4-one 1-[2-(2-bromo-4-fluoro-phenoxy)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) 1.82 7.19 -16.94 0 4 0 47 330.153 3 ↓

Analogs

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Popular Name: 1-[2-(4-iodophenoxy)acetyl]piperidin-4-one 1-[2-(4-iodophenoxy)acetyl]piper…

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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 7.59 -14.09 0 4 0 47 359.163 3 ↓

Analogs

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Popular Name: 1-[2-(3-acetylphenoxy)acetyl]piperidin-4-one 1-[2-(3-acetylphenoxy)acetyl]pip…

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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) 0.79 6.98 -23.17 0 5 0 64 275.304 4 ↓

Analogs

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Popular Name: 1-[2-(4-bromo-2-fluoro-phenoxy)acetyl]piperidin-4-one 1-[2-(4-bromo-2-fluoro-phenoxy)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) 1.82 7.17 -17.96 0 4 0 47 330.153 3 ↓

Analogs

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Popular Name: 1-[2-(4-bromo-2-chloro-6-methyl-phenoxy)acetyl]piperidin-4-one 1-[2-(4-bromo-2-chloro-6-methyl-…

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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) 2.71 8.38 -11.95 0 4 0 47 360.635 3 ↓

Analogs

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Popular Name: 1-[2-(2-allylphenoxy)acetyl]piperidin-4-one 1-[2-(2-allylphenoxy)acetyl]pipe…

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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) 1.69 8.51 -14.12 0 4 0 47 273.332 5 ↓

Analogs

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Popular Name: 1-[2-(2,4-dibromophenoxy)acetyl]piperidin-4-one 1-[2-(2,4-dibromophenoxy)acetyl]…

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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) 2.46 7.75 -16.26 0 4 0 47 391.059 3 ↓

Analogs

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Popular Name: 1-[2-(4-propanoylphenoxy)acetyl]piperidin-4-one 1-[2-(4-propanoylphenoxy)acetyl]…

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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) 1.32 7.78 -17.36 0 5 0 64 289.331 5 ↓

Analogs

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Popular Name: 1-[2-(2,4,5-trichlorophenoxy)acetyl]piperidin-4-one 1-[2-(2,4,5-trichlorophenoxy)ace…

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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) 2.81 7.99 -14.48 0 4 0 47 336.602 3 ↓

Analogs

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Popular Name: 1-[2-(4-acetylphenoxy)acetyl]piperidin-4-one 1-[2-(4-acetylphenoxy)acetyl]pip…

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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) 0.82 6.99 -17.54 0 5 0 64 275.304 4 ↓

Analogs

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Popular Name: 1-[2-(4-chloro-2,6-dimethyl-phenoxy)acetyl]piperidin-4-one 1-[2-(4-chloro-2,6-dimethyl-phen…

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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 8.36 -12.1 0 4 0 47 295.766 3 ↓

Analogs

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Popular Name: 1-[2-(2-chloro-5-nitro-phenoxy)acetyl]piperidin-4-one 1-[2-(2-chloro-5-nitro-phenoxy)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) 1.48 7.74 -15.45 0 7 0 92 312.709 4 ↓

Analogs

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Popular Name: 1-[2-[3-(methoxymethyl)phenoxy]acetyl]piperidin-4-one 1-[2-[3-(methoxymethyl)phenoxy]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) 0.85 6.22 -16.38 0 5 0 56 277.32 5 ↓

Analogs

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Popular Name: 1-[2-[2-(trifluoromethyl)phenoxy]acetyl]piperidin-4-one 1-[2-[2-(trifluoromethyl)phenoxy…

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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) 1.77 7.54 -19.07 0 4 0 47 301.264 4 ↓

Analogs

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Popular Name: N-[2-[2-oxo-2-(4-oxo-1-piperidyl)ethoxy]phenyl]acetamide N-[2-[2-oxo-2-(4-oxo-1-piperidyl…

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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) 0.09 5.47 -18.74 1 6 0 76 290.319 4 ↓

Analogs

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Popular Name: 1-[2-(2,3,5-trimethylphenoxy)acetyl]piperidin-4-one 1-[2-(2,3,5-trimethylphenoxy)ace…

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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) 2.12 8.39 -14.16 0 4 0 47 275.348 3 ↓

Analogs

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Popular Name: 1-[2-[4-(2-methoxyethyl)phenoxy]acetyl]piperidin-4-one 1-[2-[4-(2-methoxyethyl)phenoxy]…

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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) 1.08 7 -15.2 0 5 0 56 291.347 6 ↓

Parameters Provided:

ring.id = 44317
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 = 44317 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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