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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-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-[ethyl-(4-fluorophenyl)sulfonyl-amino]acetamide N-(5-tert-butyl-2-phenyl-pyrazol…

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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) 4.75 -0.67 -15.18 1 7 0 84 458.559 8 ↓

Analogs

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Popular Name: N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]-2-[(4-fluorophenyl)sulfonyl-propyl-amino]acetamide N-[5-tert-butyl-2-(4-methoxyphen…

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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) 5.31 -0.59 -15.35 1 8 0 93 502.612 10 ↓

Analogs

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Popular Name: N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]-2-[propyl(tosyl)amino]acetamide N-[5-tert-butyl-2-(4-methoxyphen…

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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) 5.60 -1.01 -15.77 1 8 0 93 498.649 10 ↓

Analogs

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Popular Name: 2-[besyl(propyl)amino]-N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]acetamide 2-[besyl(propyl)amino]-N-[5-tert…

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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) 5.15 -1.33 -15.88 1 8 0 93 484.622 10 ↓

Analogs

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Popular Name: N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]-2-[mesitylsulfonyl(propyl)amino]acetamide N-[5-tert-butyl-2-(4-methoxyphen…

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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) 6.35 0.2 -15.61 1 8 0 93 526.703 10 ↓

Analogs

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Popular Name: 2-[besyl(ethyl)amino]-N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]acetamide 2-[besyl(ethyl)amino]-N-[5-tert-…

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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) 4.75 -0.67 -14.61 1 7 0 84 458.559 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-2-[ethyl(mesitylsulfonyl)amino]acetamide N-[5-tert-butyl-2-(4-fluoropheny…

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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) 5.96 12.61 -14.39 1 7 0 84 500.64 8 ↓

Parameters Provided:

ring.id = 1047
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 = 1047 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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