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

13167053
13167053
13167054
13167054

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Popular Name: 1-(1-phenylcyclopropanecarbonyl)piperidine-4-carboxylic 1-(1-phenylcyclopropanecarbonyl)…

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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 8.85 -47.86 0 4 -1 60 272.324 3 ↓

Analogs

11891351
11891351
11891354
11891354

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Popular Name: (3S)-1-[1-(4-fluorophenyl)cyclopropanecarbonyl]piperidine-3-carboxylic (3S)-1-[1-(4-fluorophenyl)cyclop…

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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) 1.89 8.85 -54.12 0 4 -1 60 290.314 3 ↓

Analogs

11891351
11891351
11891354
11891354

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-1-[1-(4-fluorophenyl)cyclopropanecarbonyl]piperidine-3-carboxylic (3R)-1-[1-(4-fluorophenyl)cyclop…

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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) 1.89 8.9 -54.64 0 4 -1 60 290.314 3 ↓

Analogs

13167053
13167053
13167054
13167054

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Popular Name: 4-methyl-1-(1-phenylcyclopropanecarbonyl)piperidine-4-carboxylic 4-methyl-1-(1-phenylcyclopropane…

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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 9.13 -49.26 0 4 -1 60 286.351 3 ↓

Analogs

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Popular Name: (3S)-3-methyl-1-(1-phenylcyclopropanecarbonyl)piperidine-3-carboxylic (3S)-3-methyl-1-(1-phenylcyclopr…

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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 9.61 -54.72 0 4 -1 60 286.351 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-methyl-1-(1-phenylcyclopropanecarbonyl)piperidine-3-carboxylic (3R)-3-methyl-1-(1-phenylcyclopr…

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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 9.56 -56.08 0 4 -1 60 286.351 3 ↓

Analogs

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Popular Name: N-[1-[1-(3-chlorophenyl)cyclopropanecarbonyl]-4-piperidyl]-N-methyl-ethanesulfonamide N-[1-[1-(3-chlorophenyl)cyclopro…

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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) 2.53 7.43 -19.48 0 5 0 58 384.929 5 ↓

Analogs

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Popular Name: [4-(2-aminoethyl)-1-piperidyl]-(1-phenylcyclopropyl)methanone [4-(2-aminoethyl)-1-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) 1.74 6.89 -51.97 3 3 1 48 273.4 4 ↓

Analogs

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Popular Name: [4-[2-(methylamino)ethyl]-1-piperidyl]-(1-phenylcyclopropyl)methanone [4-[2-(methylamino)ethyl]-1-pipe…

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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) 2.72 8.82 -47.35 2 3 1 37 287.427 5 ↓

Analogs

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Popular Name: [(2S)-2-[2-(methylamino)ethyl]-1-piperidyl]-(1-phenylcyclopropyl)methanone [(2S)-2-[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) 2.66 8.72 -36.12 2 3 1 37 287.427 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R)-2-[2-(methylamino)ethyl]-1-piperidyl]-(1-phenylcyclopropyl)methanone [(2R)-2-[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) 2.66 8.72 -35.85 2 3 1 37 287.427 5 ↓

Analogs

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Popular Name: [1-(3-chlorophenyl)cyclopropyl]-(1-piperidyl)methanone [1-(3-chlorophenyl)cyclopropyl]-…

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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) 3.27 8.82 -6.43 0 2 0 20 263.768 2 ↓

Analogs

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Popular Name: [1-(2-chlorophenyl)cyclopropyl]-(1-piperidyl)methanone [1-(2-chlorophenyl)cyclopropyl]-…

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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) 3.25 8.58 -9.46 0 2 0 20 263.768 2 ↓

Parameters Provided:

ring.id = 35113
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 = 35113 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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