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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-methyl-1-[2-(4-piperidyl)acetyl]pyrrolidine-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) 0.32 5.51 -78.07 2 5 0 77 254.33 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-methyl-1-[2-(4-piperidyl)acetyl]pyrrolidine-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) 0.32 5.58 -76.86 2 5 0 77 254.33 3 ↓

Analogs

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Popular Name: (3S)-3-ethyl-1-[2-(4-piperidyl)acetyl]pyrrolidine-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) 0.65 6.17 -72.01 2 5 0 77 268.357 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-ethyl-1-[2-(4-piperidyl)acetyl]pyrrolidine-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) 0.65 6.08 -75.75 2 5 0 77 268.357 4 ↓

Analogs

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Popular Name: (3S)-1-[2-(4-piperidyl)acetyl]-3-propyl-pyrrolidine-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) 1.21 6.94 -74.04 2 5 0 77 282.384 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-1-[2-(4-piperidyl)acetyl]-3-propyl-pyrrolidine-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) 1.21 6.83 -78.54 2 5 0 77 282.384 5 ↓

Analogs

44726797
44726797
44726798
44726798

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-2-(4-piperidyl)ethanone 1-[(3R)-3-(dimethylamino)pyrroli…

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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) 0.47 5.69 -84.62 3 4 2 41 241.379 3 ↓
Hi High (pH 8-9.5) 0.47 3.28 -41.59 2 4 1 40 240.371 3 ↓

Analogs

44726797
44726797
44726798
44726798

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-2-(4-piperidyl)ethanone 1-[(3S)-3-(dimethylamino)pyrroli…

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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) 0.47 5.69 -84.48 3 4 2 41 241.379 3 ↓
Hi High (pH 8-9.5) 0.47 3.28 -41.47 2 4 1 40 240.371 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(3S,4S)-3-hydroxy-4-isopropoxy-pyrrolidin-1-yl]-2-(1-propyl-4-piperidyl)ethanone 1-[(3S,4S)-3-hydroxy-4-isopropox…

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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) 1.73 5.55 -39.81 2 5 1 54 313.462 6 ↓

Analogs

42434891
42434891

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-(4-piperidyl)ethanone 1-[(2R)-2-(hydroxymethyl)pyrroli…

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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 2.09 -40.84 3 4 1 57 227.328 3 ↓

Analogs

42434890
42434890

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-(4-piperidyl)ethanone 1-[(2S)-2-(hydroxymethyl)pyrroli…

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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 2.09 -41.27 3 4 1 57 227.328 3 ↓

Parameters Provided:

ring.id = 122077
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 = 122077 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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