UCSF
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Analogs

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Popular Name: N-(4-butylphenyl)-1-ethyl-2,3-dioxo-4H-quinoxaline-6-carboxamide N-(4-butylphenyl)-1-ethyl-2,3-di…

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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) 3.36 9.1 -18.46 2 6 0 84 365.433 6 ↓

Analogs

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Popular Name: 1-ethyl-N-(4-methylsulfanylphenyl)-2,3-dioxo-4H-quinoxaline-6-carboxamide 1-ethyl-N-(4-methylsulfanylpheny…

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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) 1.93 -1.07 -20.31 2 6 0 84 355.419 4 ↓

Analogs

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Popular Name: N-(5-chloro-2-propoxy-phenyl)-2,3-dioxo-1,4-dihydroquinoxaline-6-carboxamide N-(5-chloro-2-propoxy-phenyl)-2,…

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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) 2.14 5.19 -17.03 3 7 0 104 373.796 5 ↓

Analogs

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Popular Name: N-(2-ethoxy-4-methyl-phenyl)-2,3-dioxo-1,4-dihydroquinoxaline-6-carboxamide N-(2-ethoxy-4-methyl-phenyl)-2,3…

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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) 1.41 4.54 -16.48 3 7 0 104 339.351 4 ↓

Analogs

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Popular Name: 1-ethyl-2,3-dioxo-N-(4-propylphenyl)-4H-quinoxaline-6-carboxamide 1-ethyl-2,3-dioxo-N-(4-propylphe…

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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) 2.80 8.33 -18.54 2 6 0 84 351.406 5 ↓

Analogs

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Popular Name: N-(4-bromo-3-methyl-phenyl)-1-ethyl-2,3-diketo-4H-quinoxaline-6-carboxamide N-(4-bromo-3-methyl-phenyl)-1-et…

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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) 2.68 7.3 -19.03 2 6 0 84 402.248 3 ↓

Analogs

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Popular Name: N-(3-ethoxyphenyl)-2,3-dioxo-1,4-dihydroquinoxaline-6-carboxamide N-(3-ethoxyphenyl)-2,3-dioxo-1,4…

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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) 1.01 3.73 -21.04 3 7 0 104 325.324 4 ↓

Analogs

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Popular Name: N-(4-ethoxy-2-methyl-phenyl)-2,3-dioxo-1,4-dihydroquinoxaline-6-carboxamide N-(4-ethoxy-2-methyl-phenyl)-2,3…

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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) 1.41 4.63 -19.07 3 7 0 104 339.351 4 ↓

Analogs

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Popular Name: N-[3-chloro-4-(dimethylamino)phenyl]-2,3-dioxo-1,4-dihydroquinoxaline-6-carboxamide N-[3-chloro-4-(dimethylamino)phe…

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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) 1.31 5.11 -20.13 3 7 0 98 358.785 3 ↓

Analogs

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Popular Name: N-(3-butoxyphenyl)-2,3-dioxo-1,4-dihydroquinoxaline-6-carboxamide N-(3-butoxyphenyl)-2,3-dioxo-1,4…

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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) 2.07 5.31 -20.77 3 7 0 104 353.378 6 ↓

Analogs

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Popular Name: N-[2-(tert-butylcarbamoyl)phenyl]-2,3-dioxo-1,4-dihydroquinoxaline-6-carboxamide N-[2-(tert-butylcarbamoyl)phenyl…

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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) 0.93 4.41 -16.87 4 8 0 124 380.404 4 ↓

Analogs

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Popular Name: 1-ethyl-N-[2-fluoro-5-(trifluoromethyl)phenyl]-2,3-dioxo-4H-quinoxaline-6-carboxamide 1-ethyl-N-[2-fluoro-5-(trifluoro…

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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) 2.48 7.23 -18.02 2 6 0 84 395.312 4 ↓

Parameters Provided:

ring.id = 70755
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 = 70755 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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