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

Draw Identity 99% 90% 80% 70%

Popular Name: 2,3-diethyl-N-(1,3,4-thiadiazol-2-yl)quinoxaline-6-carboxamide 2,3-diethyl-N-(1,3,4-thiadiazol-…

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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) 2.91 5.08 -22.33 1 6 0 81 313.386 4 ↓
Hi High (pH 8-9.5) 2.97 4.18 -47.69 0 6 -1 87 312.378 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2,3-dimethyl-N-(1,3,4-thiadiazol-2-yl)quinoxaline-6-carboxamide 2,3-dimethyl-N-(1,3,4-thiadiazol…

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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) 1.76 3.77 -23.09 1 6 0 81 285.332 2 ↓
Hi High (pH 8-9.5) 1.83 2.87 -48.52 0 6 -1 87 284.324 2 ↓

Analogs

40165866
40165866

Draw Identity 99% 90% 80% 70%

Popular Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-2,3-dimethyl-quinoxaline-6-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) 3.11 6.81 -22.21 1 6 0 81 341.44 5 ↓
Mid Mid (pH 6-8) 3.18 5.9 -50.43 0 6 -1 87 340.432 5 ↓

Parameters Provided:

ring.id = 110621
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 = 110621 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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