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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

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-1-[4-(4-fluorophenoxy)benzoyl]piperidine-3-carboxylic (3R)-1-[4-(4-fluorophenoxy)benzo…

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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 8.9 -44.83 0 5 -1 70 342.346 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-1-[4-(4-fluorophenoxy)benzoyl]piperidine-3-carboxylic (3S)-1-[4-(4-fluorophenoxy)benzo…

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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 8.9 -55.05 0 5 -1 70 342.346 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[4-(4-fluorophenoxy)benzoyl]piperidine-4-carboxylic 1-[4-(4-fluorophenoxy)benzoyl]pi…

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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 8.94 -50.43 0 5 -1 70 342.346 4 ↓

Analogs

14232394
14232394
14232396
14232396
34844971
34844971

Draw Identity 99% 90% 80% 70%

Popular Name: [(3R,5R)-3,5-dimethyl-1-piperidyl]-(4-phenoxyphenyl)methanone [(3R,5R)-3,5-dimethyl-1-piperidy…

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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) 4.28 10.74 -8.5 0 3 0 30 309.409 3 ↓

Analogs

14232396
14232396
34844971
34844971
14232388
14232388

Draw Identity 99% 90% 80% 70%

Popular Name: [(3S,5R)-3,5-dimethyl-1-piperidyl]-(4-phenoxyphenyl)methanone [(3S,5R)-3,5-dimethyl-1-piperidy…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 4.28 10.52 -8 0 3 0 30 309.409 3 ↓

Analogs

34844971
34844971
14232388
14232388
14232394
14232394

Draw Identity 99% 90% 80% 70%

Popular Name: [(3S,5S)-3,5-dimethyl-1-piperidyl]-(4-phenoxyphenyl)methanone [(3S,5S)-3,5-dimethyl-1-piperidy…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 4.28 10.68 -8.8 0 3 0 30 309.409 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-1-[4-(3-fluorophenoxy)benzoyl]piperidine-3-carboxamide (3S)-1-[4-(3-fluorophenoxy)benzo…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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 6.04 -12.48 2 5 0 73 342.37 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-1-[4-(3-fluorophenoxy)benzoyl]piperidine-3-carboxamide (3R)-1-[4-(3-fluorophenoxy)benzo…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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 6.05 -14.23 2 5 0 73 342.37 4 ↓

Parameters Provided:

ring.id = 111979
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 = 111979 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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