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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-bromo-2-pyridyl)-2-[methyl-[(3S,5R)-5-methyl-2-oxo-tetrahydrofuran-3-yl]amino]acetamide N-(5-bromo-2-pyridyl)-2-[methyl-…

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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) 0.54 4.74 -15.4 1 6 0 72 342.193 4 ↓
Mid Mid (pH 6-8) 0.54 6.95 -46.72 2 6 1 73 343.201 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(5-bromo-2-pyridyl)-2-[methyl-[(3S,5S)-5-methyl-2-oxo-tetrahydrofuran-3-yl]amino]acetamide N-(5-bromo-2-pyridyl)-2-[methyl-…

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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) 0.54 4.47 -14.64 1 6 0 72 342.193 4 ↓
Mid Mid (pH 6-8) 0.54 6.84 -54.26 2 6 1 73 343.201 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(5-bromo-2-pyridyl)-2-[methyl-[(3R,5R)-5-methyl-2-oxo-tetrahydrofuran-3-yl]amino]acetamide N-(5-bromo-2-pyridyl)-2-[methyl-…

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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) 0.54 4.44 -21.67 1 6 0 72 342.193 4 ↓
Mid Mid (pH 6-8) 0.54 6.89 -46.45 2 6 1 73 343.201 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(5-bromo-2-pyridyl)-2-[methyl-[(3R,5S)-5-methyl-2-oxo-tetrahydrofuran-3-yl]amino]acetamide N-(5-bromo-2-pyridyl)-2-[methyl-…

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) 0.54 4.74 -15.27 1 6 0 72 342.193 4 ↓
Mid Mid (pH 6-8) 0.54 6.94 -46.51 2 6 1 73 343.201 4 ↓

Parameters Provided:

ring.id = 376784
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 = 376784 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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