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

34428949
34428949
34428948
34428948

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Popular Name: (2S)-2-cyano-N-[(3S)-1-ethyl-3-piperidyl]-3-phenyl-propanamide (2S)-2-cyano-N-[(3S)-1-ethyl-3-p…

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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) 2.17 8.37 -42.01 2 4 1 57 286.399 5 ↓
Hi High (pH 8-9.5) 2.36 6.33 -36.77 1 4 0 64 285.391 5 ↓

Analogs

34428949
34428949
34428948
34428948

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Popular Name: (2S)-2-cyano-N-[(3R)-1-ethyl-3-piperidyl]-3-phenyl-propanamide (2S)-2-cyano-N-[(3R)-1-ethyl-3-p…

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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) 2.17 8.37 -44 2 4 1 57 286.399 5 ↓
Hi High (pH 8-9.5) 2.36 6.33 -35.38 1 4 0 64 285.391 5 ↓

Analogs

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Popular Name: N-[(3R)-3-piperidyl]-3-(p-tolyl)propanamide N-[(3R)-3-piperidyl]-3-(p-tolyl)…

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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) 2.01 6.06 -46.46 3 3 1 46 247.362 4 ↓

Analogs

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Popular Name: N-[(3S)-3-piperidyl]-3-(p-tolyl)propanamide N-[(3S)-3-piperidyl]-3-(p-tolyl)…

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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) 2.01 6.06 -46.49 3 3 1 46 247.362 4 ↓

Analogs

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Popular Name: N-methyl-N-[(3R)-3-piperidyl]-3-(p-tolyl)propanamide N-methyl-N-[(3R)-3-piperidyl]-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) 2.26 7.86 -43.63 2 3 1 37 261.389 4 ↓

Analogs

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Popular Name: N-methyl-N-[(3S)-3-piperidyl]-3-(p-tolyl)propanamide N-methyl-N-[(3S)-3-piperidyl]-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) 2.26 7.86 -43.26 2 3 1 37 261.389 4 ↓

Analogs

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Popular Name: N-[(3R)-3-piperidyl]-N-propyl-3-(p-tolyl)propanamide N-[(3R)-3-piperidyl]-N-propyl-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) 3.14 9.58 -40.14 2 3 1 37 289.443 6 ↓

Analogs

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Popular Name: N-[(3S)-3-piperidyl]-N-propyl-3-(p-tolyl)propanamide N-[(3S)-3-piperidyl]-N-propyl-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) 3.14 9.58 -39.53 2 3 1 37 289.443 6 ↓

Analogs

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Popular Name: 3-(3-aminophenyl)-N-[(3S)-1-ethyl-3-piperidyl]propanamide 3-(3-aminophenyl)-N-[(3S)-1-ethy…

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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) 1.59 6.14 -40.81 4 4 1 60 276.404 5 ↓

Analogs

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Popular Name: 3-(3-aminophenyl)-N-[(3R)-1-ethyl-3-piperidyl]propanamide 3-(3-aminophenyl)-N-[(3R)-1-ethy…

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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) 1.59 6.14 -40.86 4 4 1 60 276.404 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-(2-aminophenyl)-N-[(3S)-1-ethyl-3-piperidyl]propanamide 3-(2-aminophenyl)-N-[(3S)-1-ethy…

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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) 1.97 6.23 -40.49 4 4 1 60 276.404 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-(2-aminophenyl)-N-[(3R)-1-ethyl-3-piperidyl]propanamide 3-(2-aminophenyl)-N-[(3R)-1-ethy…

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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) 1.97 6.23 -40.78 4 4 1 60 276.404 5 ↓

Parameters Provided:

ring.id = 9667
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 = 9667 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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