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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: 1-allyloxy-4-oxido-3-(p-tolyl)quinoxalin-4-ium-2-one 1-allyloxy-4-oxido-3-(p-tolyl)qu…

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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) 0.90 9.87 -17.14 0 5 0 60 308.337 4 ↓
Mid Mid (pH 6-8) 0.90 9.09 -27.3 1 5 1 57 309.345 4 ↓

Analogs

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Popular Name: 3-(4-bromophenyl)-1-hydroxy-4-oxido-quinoxalin-4-ium-2-one 3-(4-bromophenyl)-1-hydroxy-4-ox…

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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) 0.34 7.17 -57.63 0 5 -1 74 332.133 1 ↓

Analogs

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Popular Name: 3-(2,4-dimethoxyphenyl)-1-hydroxy-4-oxido-quinoxalin-4-ium-2-one 3-(2,4-dimethoxyphenyl)-1-hydrox…

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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) -0.43 6.08 -65.12 0 7 -1 93 313.289 3 ↓

Analogs

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Popular Name: 3-(3-bromophenyl)-1-hydroxy-4-oxido-quinoxalin-4-ium-2-one 3-(3-bromophenyl)-1-hydroxy-4-ox…

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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) 0.31 7.16 -58.37 0 5 -1 74 332.133 1 ↓

Analogs

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Popular Name: 1-hydroxy-4-oxido-3-(4-propoxyphenyl)quinoxalin-4-ium-2-one 1-hydroxy-4-oxido-3-(4-propoxyph…

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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) 0.46 7.58 -60.8 0 6 -1 83 311.317 4 ↓

Analogs

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Popular Name: 1-hydroxy-4-oxido-3-[3-(trifluoromethyl)phenyl]quinoxalin-4-ium-2-one 1-hydroxy-4-oxido-3-[3-(trifluor…

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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) 0.40 7.55 -57.55 0 5 -1 74 321.234 2 ↓

Analogs

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Popular Name: 3-(2,5-dimethoxyphenyl)-1-hydroxy-4-oxido-quinoxalin-4-ium-2-one 3-(2,5-dimethoxyphenyl)-1-hydrox…

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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) -0.43 6.07 -70.33 0 7 -1 93 313.289 3 ↓

Analogs

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Popular Name: 1-hydroxy-3-(4-iodophenyl)-4-oxido-quinoxalin-4-ium-2-one 1-hydroxy-3-(4-iodophenyl)-4-oxi…

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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) 0.61 7.64 -57.54 0 5 -1 74 379.133 1 ↓

Analogs

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Popular Name: 1-hydroxy-4-oxido-3-phenyl-quinoxalin-4-ium-2-one 1-hydroxy-4-oxido-3-phenyl-quino…

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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) -0.47 6.54 -62.5 0 5 -1 74 253.237 1 ↓

Parameters Provided:

ring.id = 26345
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 = 26345 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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