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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: (3R)-3-[[(4R)-2,2-dimethyltetrahydropyran-4-yl]amino]piperidin-2-one (3R)-3-[[(4R)-2,2-dimethyltetrah…

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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 1.93 -39.2 3 4 1 55 227.328 2 ↓
Hi High (pH 8-9.5) 0.78 0.91 -7.44 2 4 0 50 226.32 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-[[(4S)-2,2-dimethyltetrahydropyran-4-yl]amino]piperidin-2-one (3R)-3-[[(4S)-2,2-dimethyltetrah…

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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 1.93 -38.32 3 4 1 55 227.328 2 ↓
Hi High (pH 8-9.5) 0.78 0.85 -6.29 2 4 0 50 226.32 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-[[(4R)-2,2-dimethyltetrahydropyran-4-yl]amino]piperidin-2-one (3S)-3-[[(4R)-2,2-dimethyltetrah…

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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 1.95 -38.32 3 4 1 55 227.328 2 ↓
Hi High (pH 8-9.5) 0.78 0.86 -8.01 2 4 0 50 226.32 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-[[(4S)-2,2-dimethyltetrahydropyran-4-yl]amino]piperidin-2-one (3S)-3-[[(4S)-2,2-dimethyltetrah…

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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 1.91 -39.17 3 4 1 55 227.328 2 ↓
Hi High (pH 8-9.5) 0.78 0.92 -9.79 2 4 0 50 226.32 2 ↓

Analogs

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Popular Name: (3R)-3-[[(2R,4R)-2-ethyltetrahydropyran-4-yl]amino]piperidin-2-one (3R)-3-[[(2R,4R)-2-ethyltetrahyd…

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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 2.36 -39.15 3 4 1 55 227.328 3 ↓
Hi High (pH 8-9.5) 0.83 1.36 -7.14 2 4 0 50 226.32 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-[[(2S,4R)-2-ethyltetrahydropyran-4-yl]amino]piperidin-2-one (3R)-3-[[(2S,4R)-2-ethyltetrahyd…

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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 2.55 -38.96 3 4 1 55 227.328 3 ↓
Hi High (pH 8-9.5) 0.83 1.63 -6.97 2 4 0 50 226.32 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-[[(2R,4S)-2-ethyltetrahydropyran-4-yl]amino]piperidin-2-one (3R)-3-[[(2R,4S)-2-ethyltetrahyd…

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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 2.56 -36.97 3 4 1 55 227.328 3 ↓
Hi High (pH 8-9.5) 0.83 1.77 -6.44 2 4 0 50 226.32 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-[[(2S,4S)-2-ethyltetrahydropyran-4-yl]amino]piperidin-2-one (3R)-3-[[(2S,4S)-2-ethyltetrahyd…

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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 2.39 -38.43 3 4 1 55 227.328 3 ↓
Hi High (pH 8-9.5) 0.83 1.28 -6.55 2 4 0 50 226.32 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-[[(2R,4R)-2-methyltetrahydropyran-4-yl]amino]piperidin-2-one (3R)-3-[[(2R,4R)-2-methyltetrahy…

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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) 0.33 1.53 -39.03 3 4 1 55 213.301 2 ↓
Hi High (pH 8-9.5) 0.33 0.53 -7.35 2 4 0 50 212.293 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-[[(2S,4R)-2-methyltetrahydropyran-4-yl]amino]piperidin-2-one (3R)-3-[[(2S,4R)-2-methyltetrahy…

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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) 0.33 1.27 -38.62 3 4 1 55 213.301 2 ↓
Hi High (pH 8-9.5) 0.33 0.26 -7.36 2 4 0 50 212.293 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-[[(2R,4S)-2-methyltetrahydropyran-4-yl]amino]piperidin-2-one (3R)-3-[[(2R,4S)-2-methyltetrahy…

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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) 0.33 1.29 -38 3 4 1 55 213.301 2 ↓
Hi High (pH 8-9.5) 0.33 0.2 -6.3 2 4 0 50 212.293 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-[[(2S,4S)-2-methyltetrahydropyran-4-yl]amino]piperidin-2-one (3R)-3-[[(2S,4S)-2-methyltetrahy…

Find On: PubMed — Wikipedia — Google

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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) 0.33 1.56 -38.3 3 4 1 55 213.301 2 ↓
Hi High (pH 8-9.5) 0.33 0.46 -6.67 2 4 0 50 212.293 2 ↓

Parameters Provided:

ring.id = 490331
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 = 490331 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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