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

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Popular Name: N-tert-butyl-4-oxo-4-(3-phenyl-4,5-dihydropyrazol-1-yl)butanamide N-tert-butyl-4-oxo-4-(3-phenyl-4…

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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) 2.13 6.66 -12.5 1 5 0 62 301.39 5 ↓

Analogs

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Popular Name: [2-[[(1R)-1,2-dimethylpropyl]amino]-2-oxo-ethyl] [2-[[(1R)-1,2-dimethylpropyl]ami…

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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) 1.96 9.16 -14.75 1 7 0 88 373.453 9 ↓

Analogs

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Popular Name: [2-[[(1S)-1,2-dimethylpropyl]amino]-2-oxo-ethyl] [2-[[(1S)-1,2-dimethylpropyl]ami…

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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) 1.96 9.46 -14.92 1 7 0 88 373.453 9 ↓

Analogs

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Popular Name: N-butyl-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide N-butyl-4-oxo-4-(5-phenyl-3,4-di…

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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) 2.39 6.94 -11.6 1 5 0 62 301.39 7 ↓

Analogs

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Popular Name: N-(3-methoxypropyl)-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide N-(3-methoxypropyl)-4-oxo-4-(5-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) 1.20 5.23 -12.44 1 6 0 71 317.389 8 ↓

Analogs

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Popular Name: N-isopentyl-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide N-isopentyl-4-oxo-4-(5-phenyl-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) 2.60 7.46 -11.57 1 5 0 62 315.417 7 ↓

Analogs

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Popular Name: N-ethyl-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide N-ethyl-4-oxo-4-(5-phenyl-3,4-di…

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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) 1.32 5.41 -11.83 1 5 0 62 273.336 5 ↓

Analogs

4551652
4551652

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Popular Name: tert-butyl tert-butyl

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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) 3.41 0.66 -9.88 1 6 0 71 360.332 5 ↓

Analogs

4551651
4551651

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Popular Name: tert-butyl tert-butyl

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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) 3.41 0.64 -9.83 1 6 0 71 360.332 5 ↓

Parameters Provided:

ring.id = 42007
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 = 42007 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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