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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: 2-methyl-1,3-dioxo-N-(1,3,4-thiadiazol-2-yl)isoindoline-5-carboxamide 2-methyl-1,3-dioxo-N-(1,3,4-thia…

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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) 1.11 3.45 -24.3 1 7 0 94 288.288 2 ↓
Hi High (pH 8-9.5) 1.18 2.54 -41.71 0 7 -1 100 287.28 2 ↓

Analogs

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Popular Name: N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-2-(3-methoxypropyl)-1,3-dioxo-isoindoline-5-carboxamide N-[5-(1-ethylpropyl)-1,3,4-thiad…

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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) 2.82 7.7 -21.45 1 8 0 103 416.503 9 ↓

Analogs

23359926
23359926

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Popular Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-methyl-1,3-dioxo-isoindoline-5-carboxamide N-(5-butyl-1,3,4-thiadiazol-2-yl…

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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) 2.46 6.48 -23.41 1 7 0 94 344.396 5 ↓
Mid Mid (pH 6-8) 2.53 5.58 -43.5 0 7 -1 100 343.388 5 ↓

Analogs

6558193
6558193

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Popular Name: 2-butyl-N-(5-butyl-1,3,4-thiadiazol-2-yl)-1,3-dioxo-isoindoline-5-carboxamide 2-butyl-N-(5-butyl-1,3,4-thiadia…

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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) 3.90 9.01 -22.96 1 7 0 94 386.477 8 ↓
Mid Mid (pH 6-8) 3.96 8.11 -43.25 0 7 -1 100 385.469 8 ↓

Parameters Provided:

ring.id = 110729
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 = 110729 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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