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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: 4-[5-(3-hydroxyprop-1-ynyl)pyridine-3-carbonyl]piperazin-2-one 4-[5-(3-hydroxyprop-1-ynyl)pyrid…

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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 -0.6 -14.81 2 6 0 83 259.265 1 ↓

Analogs

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Popular Name: 4-[5-(4-hydroxybut-1-ynyl)pyridine-3-carbonyl]piperazin-2-one 4-[5-(4-hydroxybut-1-ynyl)pyridi…

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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) -1.04 0.15 -13.14 2 6 0 83 273.292 2 ↓

Analogs

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Popular Name: (E)-3-[5-(3-oxopiperazine-1-carbonyl)-3-pyridyl]prop-2-enoic (E)-3-[5-(3-oxopiperazine-1-carb…

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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) -1.09 2.53 -52.86 1 7 -1 102 274.256 3 ↓

Analogs

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Popular Name: 4-[5-(3-aminoprop-1-ynyl)pyridine-3-carbonyl]piperazin-2-one 4-[5-(3-aminoprop-1-ynyl)pyridin…

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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) -1.88 0.09 -55.99 4 6 1 90 259.289 1 ↓
Mid Mid (pH 6-8) -1.88 -0.31 -12.85 3 6 0 88 258.281 1 ↓

Analogs

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Popular Name: 4-(6-isopropoxypyridine-3-carbonyl)piperazin-2-one 4-(6-isopropoxypyridine-3-carbon…

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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) 0.27 1.06 -12.23 1 6 0 72 263.297 3 ↓

Analogs

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Popular Name: 4-[2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carbonyl]piperazin-2-one 4-[2-oxo-6-(trifluoromethyl)-1H-…

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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) 0.17 -0.97 -53.74 1 6 -1 85 288.205 2 ↓
Lo Low (pH 4.5-6) -0.28 0.46 -19.26 2 6 0 82 289.213 2 ↓

Analogs

44885009
44885009

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Popular Name: 4-(6-ethoxypyridine-3-carbonyl)piperazin-2-one 4-(6-ethoxypyridine-3-carbonyl)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) -0.09 0.01 -11.34 1 6 0 72 249.27 3 ↓

Analogs

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Popular Name: 5-(3-oxopiperazine-1-carbonyl)pyridine-2-carboxamide 5-(3-oxopiperazine-1-carbonyl)py…

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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 -2.58 -14.22 3 7 0 105 248.242 2 ↓

Parameters Provided:

ring.id = 2640
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 = 2640 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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