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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

42447120
42447120

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[2-(4-ethyl-4-methyl-1-piperidyl)acetyl]piperidin-4-one 1-[2-(4-ethyl-4-methyl-1-piperid…

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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) 1.16 7.53 -46.38 1 4 1 42 267.393 3 ↓
Hi High (pH 8-9.5) 1.16 5.35 -10.03 0 4 0 41 266.385 3 ↓

Analogs

42447120
42447120

Draw Identity 99% 90% 80% 70%

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

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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) 1.50 8 -46.87 1 4 1 42 281.42 4 ↓
Hi High (pH 8-9.5) 1.50 5.82 -9.84 0 4 0 41 280.412 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[2-[(2S,6R)-2,6-dimethyl-1-piperidyl]acetyl]piperidin-4-one 1-[2-[(2S,6R)-2,6-dimethyl-1-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) 0.83 6.85 -40.96 1 4 1 42 253.366 2 ↓
Hi High (pH 8-9.5) 0.83 4.71 -8.96 0 4 0 41 252.358 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[2-[(2S,6S)-2,6-dimethyl-1-piperidyl]acetyl]piperidin-4-one 1-[2-[(2S,6S)-2,6-dimethyl-1-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) 0.83 6.79 -39.96 1 4 1 42 253.366 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[2-[(2R,6R)-2,6-dimethyl-1-piperidyl]acetyl]piperidin-4-one 1-[2-[(2R,6R)-2,6-dimethyl-1-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) 0.83 6.82 -39.94 1 4 1 42 253.366 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[2-(4-methoxy-1-piperidyl)acetyl]piperidin-4-one 1-[2-(4-methoxy-1-piperidyl)acet…

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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) -1.09 5.15 -49.29 1 5 1 51 255.338 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[2-[(3R)-3-ethyl-1-piperidyl]acetyl]piperidin-4-one 1-[2-[(3R)-3-ethyl-1-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 7.39 -45.65 1 4 1 42 253.366 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[2-[(3S)-3-ethyl-1-piperidyl]acetyl]piperidin-4-one 1-[2-[(3S)-3-ethyl-1-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 7.39 -45.67 1 4 1 42 253.366 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[2-[4-(dimethylamino)-1-piperidyl]acetyl]piperidin-4-one 1-[2-[4-(dimethylamino)-1-piperi…

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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) -0.32 4.97 -41.41 1 5 1 45 268.381 3 ↓
Lo Low (pH 4.5-6) -0.31 7.16 -110.48 2 5 2 46 269.389 3 ↓

Analogs

42438051
42438051
42438052
42438052
42438053
42438053

Draw Identity 99% 90% 80% 70%

Popular Name: (3S,6R)-6-methyl-1-[2-oxo-2-(4-oxo-1-piperidyl)ethyl]piperidine-3-carboxamide (3S,6R)-6-methyl-1-[2-oxo-2-(4-o…

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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) -0.90 3.54 -45.75 3 6 1 85 282.364 3 ↓

Analogs

42438052
42438052
42438053
42438053
42438050
42438050

Draw Identity 99% 90% 80% 70%

Popular Name: (3S,6S)-6-methyl-1-[2-oxo-2-(4-oxo-1-piperidyl)ethyl]piperidine-3-carboxamide (3S,6S)-6-methyl-1-[2-oxo-2-(4-o…

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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) -0.90 3.25 -48.67 3 6 1 85 282.364 3 ↓

Analogs

42438053
42438053
42438050
42438050
42438051
42438051

Draw Identity 99% 90% 80% 70%

Popular Name: (3R,6R)-6-methyl-1-[2-oxo-2-(4-oxo-1-piperidyl)ethyl]piperidine-3-carboxamide (3R,6R)-6-methyl-1-[2-oxo-2-(4-o…

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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) -0.90 3.25 -49.07 3 6 1 85 282.364 3 ↓

Analogs

42438050
42438050
42438051
42438051
42438052
42438052

Draw Identity 99% 90% 80% 70%

Popular Name: (3R,6S)-6-methyl-1-[2-oxo-2-(4-oxo-1-piperidyl)ethyl]piperidine-3-carboxamide (3R,6S)-6-methyl-1-[2-oxo-2-(4-o…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) -0.90 3.54 -46.16 3 6 1 85 282.364 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[1-[2-oxo-2-(4-oxo-1-piperidyl)ethyl]-4-piperidyl]acetamide 2-[1-[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) -0.78 3.52 -51.34 3 6 1 85 282.364 4 ↓

Analogs

42457527
42457527
61820685
61820685
62954879
62954879
62954953
62954953
35039991
35039991

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[2-(4-ethyl-1-piperidyl)acetyl]piperidin-4-one 1-[2-(4-ethyl-1-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) 1.10 7.41 -46.12 1 4 1 42 253.366 3 ↓

Parameters Provided:

ring.id = 318525
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 = 318525 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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