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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4-piperidyl)-1-(4-propyl-1-piperidyl)ethanone 2-(4-piperidyl)-1-(4-propyl-1-pi…

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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) 2.72 7.36 -40.69 2 3 1 37 253.41 4 ↓

Analogs

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Popular Name: 1-(4-methyl-1-piperidyl)-2-(4-piperidyl)ethanone 1-(4-methyl-1-piperidyl)-2-(4-pi…

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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) 1.47 5.91 -42.67 2 3 1 37 225.356 2 ↓

Analogs

37821184
37821184
37833456
37833456

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Popular Name: 1-(1-piperidyl)-2-(4-piperidyl)ethanone 1-(1-piperidyl)-2-(4-piperidyl)e…

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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) 1.23 5.32 -42.72 2 3 1 37 211.329 2 ↓

Analogs

36153992
36153992
36347044
36347044
36347045
36347045
36347052
36347052
36347053
36347053

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Popular Name: 3-methyl-N-[(1S)-2-oxo-2-(1-piperidyl)-1-(4-piperidyl)ethyl]butanamide 3-methyl-N-[(1S)-2-oxo-2-(1-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) 1.53 5.88 -42.46 3 5 1 66 310.462 5 ↓

Analogs

36347044
36347044
36347045
36347045
36347052
36347052
36347053
36347053
36347088
36347088

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Popular Name: 3-methyl-N-[(1R)-2-oxo-2-(1-piperidyl)-1-(4-piperidyl)ethyl]butanamide 3-methyl-N-[(1R)-2-oxo-2-(1-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) 1.53 5.91 -42.98 3 5 1 66 310.462 5 ↓

Analogs

9763247
9763247
19809289
19809289

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Popular Name: 1-[(2R)-2-ethyl-1-piperidyl]-2-(4-piperidyl)ethanone 1-[(2R)-2-ethyl-1-piperidyl]-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) 2.10 6.54 -39.31 2 3 1 37 239.383 3 ↓

Analogs

9763247
9763247
19809289
19809289

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(2S)-2-ethyl-1-piperidyl]-2-(4-piperidyl)ethanone 1-[(2S)-2-ethyl-1-piperidyl]-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) 2.10 6.57 -39.23 2 3 1 37 239.383 3 ↓

Analogs

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Popular Name: 4-methyl-1-[2-(4-piperidyl)acetyl]piperidine-4-carboxylic 4-methyl-1-[2-(4-piperidyl)acety…

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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) 0.59 6.17 -76.56 2 5 0 77 268.357 3 ↓

Analogs

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Popular Name: 4-ethyl-1-[2-(4-piperidyl)acetyl]piperidine-4-carboxylic 4-ethyl-1-[2-(4-piperidyl)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) 0.92 6.64 -75.58 2 5 0 77 282.384 4 ↓

Analogs

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Popular Name: 1-[2-(4-piperidyl)acetyl]-4-propyl-piperidine-4-carboxylic 1-[2-(4-piperidyl)acetyl]-4-prop…

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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 7.41 -76.05 2 5 0 77 296.411 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-methyl-1-[2-(4-piperidyl)acetyl]piperidine-3-carboxylic (3S)-3-methyl-1-[2-(4-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) 0.59 6.6 -80.01 2 5 0 77 268.357 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-methyl-1-[2-(4-piperidyl)acetyl]piperidine-3-carboxylic (3R)-3-methyl-1-[2-(4-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) 0.59 6.57 -79.96 2 5 0 77 268.357 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-ethyl-1-[2-(4-piperidyl)acetyl]piperidine-3-carboxylic (3S)-3-ethyl-1-[2-(4-piperidyl)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) 0.92 7.1 -79.15 2 5 0 77 282.384 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-ethyl-1-[2-(4-piperidyl)acetyl]piperidine-3-carboxylic (3R)-3-ethyl-1-[2-(4-piperidyl)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) 0.92 7.03 -79.38 2 5 0 77 282.384 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-1-[2-(4-piperidyl)acetyl]-3-propyl-piperidine-3-carboxylic (3S)-1-[2-(4-piperidyl)acetyl]-3…

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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 7.85 -79.85 2 5 0 77 296.411 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-1-[2-(4-piperidyl)acetyl]-3-propyl-piperidine-3-carboxylic (3R)-1-[2-(4-piperidyl)acetyl]-3…

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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 7.8 -79.72 2 5 0 77 296.411 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(4-ethyl-4-methyl-1-piperidyl)-2-(4-piperidyl)ethanone 1-(4-ethyl-4-methyl-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) 2.22 6.72 -40.45 2 3 1 37 253.41 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(4,4-diethyl-1-piperidyl)-2-(4-piperidyl)ethanone 1-(4,4-diethyl-1-piperidyl)-2-(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) 2.56 7.19 -40.48 2 3 1 37 267.437 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: tert-butyl tert-butyl

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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 5.05 -13.47 1 6 0 70 326.437 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: tert-butyl tert-butyl

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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 5.07 -13.34 1 6 0 70 326.437 4 ↓

Parameters Provided:

ring.id = 16667
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 = 16667 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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