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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

11844316
11844316

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Popular Name: (3R)-1-(cyclohexylmethyl)-N-isopropyl-N-(2-methoxyethyl)-6-oxo-piperidine-3-carboxamide (3R)-1-(cyclohexylmethyl)-N-isop…

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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) 2.73 0.74 -11.95 0 5 0 50 338.492 7 ↓

Analogs

11844315
11844315

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Popular Name: (3S)-1-(cyclohexylmethyl)-N-isopropyl-N-(2-methoxyethyl)-6-oxo-piperidine-3-carboxamide (3S)-1-(cyclohexylmethyl)-N-isop…

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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) 2.73 0.75 -10.36 0 5 0 50 338.492 7 ↓

Analogs

12209390
12209390

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Popular Name: methyl methyl

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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) 1.69 -0.74 -10.38 1 6 0 76 310.394 6 ↓

Analogs

12209383
12209383

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Popular Name: methyl methyl

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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) 1.69 -0.61 -10.89 1 6 0 76 310.394 6 ↓

Analogs

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Popular Name: (3R)-1-[(1S)-1-cyclohexylethyl]-6-oxo-piperidine-3-carboxylic (3R)-1-[(1S)-1-cyclohexylethyl]-…

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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) 2.30 8.37 -41.8 0 4 -1 60 252.334 3 ↓

Analogs

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Popular Name: (3R)-1-[(1R)-1-cyclohexylethyl]-6-oxo-piperidine-3-carboxylic (3R)-1-[(1R)-1-cyclohexylethyl]-…

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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) 2.30 8.51 -41.15 0 4 -1 60 252.334 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-1-[(1S)-1-cyclohexylethyl]-6-oxo-piperidine-3-carboxylic (3S)-1-[(1S)-1-cyclohexylethyl]-…

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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) 2.30 8.47 -40.35 0 4 -1 60 252.334 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-1-[(1R)-1-cyclohexylethyl]-6-oxo-piperidine-3-carboxylic (3S)-1-[(1R)-1-cyclohexylethyl]-…

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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) 2.30 8.46 -40.27 0 4 -1 60 252.334 3 ↓

Analogs

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Popular Name: (2R,3R,4R)-1-[(1S)-1-cyclohexylethyl]-2,4-dimethyl-6-oxo-piperidine-3-carboxylic (2R,3R,4R)-1-[(1S)-1-cyclohexyle…

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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) 3.11 8.86 -39.65 0 4 -1 60 280.388 3 ↓

Analogs

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Popular Name: (2R,3R,4S)-1-[(1S)-1-cyclohexylethyl]-2,4-dimethyl-6-oxo-piperidine-3-carboxylic (2R,3R,4S)-1-[(1S)-1-cyclohexyle…

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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) 3.11 8.6 -41.39 0 4 -1 60 280.388 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3R,4R)-1-[(1S)-1-cyclohexylethyl]-2,4-dimethyl-6-oxo-piperidine-3-carboxylic (2S,3R,4R)-1-[(1S)-1-cyclohexyle…

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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) 3.11 8.49 -38.69 0 4 -1 60 280.388 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3R,4S)-1-[(1S)-1-cyclohexylethyl]-2,4-dimethyl-6-oxo-piperidine-3-carboxylic (2S,3R,4S)-1-[(1S)-1-cyclohexyle…

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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) 3.11 8.72 -41.84 0 4 -1 60 280.388 3 ↓

Analogs

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Popular Name: (3R)-1-[(1S)-1-cyclohexylpropyl]-6-oxo-piperidine-3-carboxylic (3R)-1-[(1S)-1-cyclohexylpropyl]…

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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) 2.84 9.57 -41.11 0 4 -1 60 266.361 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-1-[(1R)-1-cyclohexylpropyl]-6-oxo-piperidine-3-carboxylic (3R)-1-[(1R)-1-cyclohexylpropyl]…

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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) 2.84 9.55 -41.76 0 4 -1 60 266.361 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-1-[(1S)-1-cyclohexylpropyl]-6-oxo-piperidine-3-carboxylic (3S)-1-[(1S)-1-cyclohexylpropyl]…

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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) 2.84 9.51 -40.89 0 4 -1 60 266.361 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-1-[(1R)-1-cyclohexylpropyl]-6-oxo-piperidine-3-carboxylic (3S)-1-[(1R)-1-cyclohexylpropyl]…

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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) 2.84 9.53 -40.3 0 4 -1 60 266.361 4 ↓

Analogs

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Popular Name: (2R,3R,4R)-1-[(1S)-1-cyclohexylpropyl]-2,4-dimethyl-6-oxo-piperidine-3-carboxylic (2R,3R,4R)-1-[(1S)-1-cyclohexylp…

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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) 3.64 9.52 -39.19 0 4 -1 60 294.415 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R,3R,4R)-1-[(1R)-1-cyclohexylpropyl]-2,4-dimethyl-6-oxo-piperidine-3-carboxylic (2R,3R,4R)-1-[(1R)-1-cyclohexylp…

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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) 3.64 9.93 -39.91 0 4 -1 60 294.415 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3R,4R)-1-[(1S)-1-cyclohexylpropyl]-2,4-dimethyl-6-oxo-piperidine-3-carboxylic (2S,3R,4R)-1-[(1S)-1-cyclohexylp…

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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) 3.64 10.07 -41.36 0 4 -1 60 294.415 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3R,4R)-1-[(1R)-1-cyclohexylpropyl]-2,4-dimethyl-6-oxo-piperidine-3-carboxylic (2S,3R,4R)-1-[(1R)-1-cyclohexylp…

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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) 3.64 10.09 -41.4 0 4 -1 60 294.415 4 ↓

Parameters Provided:

ring.id = 61103
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 = 61103 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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