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

44513640
44513640
22787300
22787300

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[2-(4-amino-1-piperidyl)acetyl]oxazolidin-2-one 3-[2-(4-amino-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) -1.33 -0.37 -47.64 3 6 1 77 228.272 2 ↓
Hi High (pH 8-9.5) -1.33 -0.69 -8.25 2 6 0 76 227.264 2 ↓
Lo Low (pH 4.5-6) -1.33 1.82 -104.36 4 6 2 79 229.28 2 ↓

Analogs

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Popular Name: 4-methyl-1-[2-oxo-2-(2-oxooxazolidin-3-yl)ethyl]piperidine-4-carboxylic 4-methyl-1-[2-oxo-2-(2-oxooxazol…

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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 5.4 -58.54 1 7 0 91 270.285 3 ↓
Hi High (pH 8-9.5) -0.33 3.23 -54.27 0 7 -1 90 269.277 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-ethyl-1-[2-oxo-2-(2-oxooxazolidin-3-yl)ethyl]piperidine-4-carboxylic 4-ethyl-1-[2-oxo-2-(2-oxooxazoli…

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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) 0.00 5.87 -57.83 1 7 0 91 284.312 4 ↓
Hi High (pH 8-9.5) 0.00 3.7 -53.55 0 7 -1 90 283.304 4 ↓

Analogs

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Popular Name: 1-[2-oxo-2-(2-oxooxazolidin-3-yl)ethyl]-4-propyl-piperidine-4-carboxylic 1-[2-oxo-2-(2-oxooxazolidin-3-yl…

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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) 0.56 6.61 -57.83 1 7 0 91 298.339 5 ↓
Hi High (pH 8-9.5) 0.56 4.43 -53.81 0 7 -1 90 297.331 5 ↓

Analogs

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Popular Name: (3S)-3-methyl-1-[2-oxo-2-(2-oxooxazolidin-3-yl)ethyl]piperidine-3-carboxylic (3S)-3-methyl-1-[2-oxo-2-(2-oxoo…

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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 5.58 -47.9 1 7 0 91 270.285 3 ↓
Hi High (pH 8-9.5) -0.33 3.78 -52.49 0 7 -1 90 269.277 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-methyl-1-[2-oxo-2-(2-oxooxazolidin-3-yl)ethyl]piperidine-3-carboxylic (3R)-3-methyl-1-[2-oxo-2-(2-oxoo…

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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 5.55 -47.45 1 7 0 91 270.285 3 ↓
Hi High (pH 8-9.5) -0.33 3.75 -52.37 0 7 -1 90 269.277 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-ethyl-1-[2-oxo-2-(2-oxooxazolidin-3-yl)ethyl]piperidine-3-carboxylic (3S)-3-ethyl-1-[2-oxo-2-(2-oxoox…

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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) 0.00 6.12 -38.57 1 7 0 91 284.312 4 ↓
Hi High (pH 8-9.5) 0.00 4.6 -53.65 0 7 -1 90 283.304 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-ethyl-1-[2-oxo-2-(2-oxooxazolidin-3-yl)ethyl]piperidine-3-carboxylic (3R)-3-ethyl-1-[2-oxo-2-(2-oxoox…

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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) 0.00 6.18 -39.91 1 7 0 91 284.312 4 ↓
Hi High (pH 8-9.5) 0.00 4.59 -55.96 0 7 -1 90 283.304 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-1-[2-oxo-2-(2-oxooxazolidin-3-yl)ethyl]-3-propyl-piperidine-3-carboxylic (3S)-1-[2-oxo-2-(2-oxooxazolidin…

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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) 0.56 6.82 -47.12 1 7 0 91 298.339 5 ↓
Hi High (pH 8-9.5) 0.56 5.03 -52.31 0 7 -1 90 297.331 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-1-[2-oxo-2-(2-oxooxazolidin-3-yl)ethyl]-3-propyl-piperidine-3-carboxylic (3R)-1-[2-oxo-2-(2-oxooxazolidin…

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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) 0.56 6.94 -39.87 1 7 0 91 298.339 5 ↓
Hi High (pH 8-9.5) 0.56 5.36 -56.41 0 7 -1 90 297.331 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[2-[4-(2-aminoethyl)-1-piperidyl]acetyl]oxazolidin-2-one 3-[2-[4-(2-aminoethyl)-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) -0.56 3.2 -92.59 4 6 2 79 257.334 4 ↓
Hi High (pH 8-9.5) -0.56 1.02 -49.08 3 6 1 77 256.326 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[2-[4-[2-(methylamino)ethyl]-1-piperidyl]acetyl]oxazolidin-2-one 3-[2-[4-[2-(methylamino)ethyl]-1…

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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) 0.42 5.07 -89.56 3 6 2 68 271.361 5 ↓
Hi High (pH 8-9.5) 0.42 2.89 -44.87 2 6 1 66 270.353 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[2-[(2S)-2-[2-(methylamino)ethyl]-1-piperidyl]acetyl]oxazolidin-2-one 3-[2-[(2S)-2-[2-(methylamino)eth…

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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) 0.36 3.46 -40.94 2 6 1 66 270.353 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[2-[(2R)-2-[2-(methylamino)ethyl]-1-piperidyl]acetyl]oxazolidin-2-one 3-[2-[(2R)-2-[2-(methylamino)eth…

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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) 0.36 2.86 -44.04 2 6 1 66 270.353 5 ↓

Parameters Provided:

ring.id = 110459
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 = 110459 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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