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Analogs

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Popular Name: 2-[6-(4-chlorophenyl)-3-oxo-[1,2,4]triazolo[3,4-f]pyridazin-2-yl]-N-(3,4-dimethoxyphenyl)acetamide 2-[6-(4-chlorophenyl)-3-oxo-[1,2…

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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) 2.77 8.4 -28.91 1 9 0 100 439.859 6 ↓

Analogs

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Popular Name: 2-[6-(4-chlorophenyl)-3-oxo-[1,2,4]triazolo[3,4-f]pyridazin-2-yl]-N-(3,5-dimethoxyphenyl)acetamide 2-[6-(4-chlorophenyl)-3-oxo-[1,2…

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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) 3.16 7.81 -29.19 1 9 0 100 439.859 6 ↓

Analogs

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Popular Name: 2-[6-(4-chlorophenyl)-3-oxo-[1,2,4]triazolo[3,4-f]pyridazin-2-yl]-N-(3-fluoro-4-methyl-phenyl)acetam 2-[6-(4-chlorophenyl)-3-oxo-[1,2…

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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) 3.66 9.91 -25.35 1 7 0 81 411.824 4 ↓

Analogs

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Popular Name: 2-[6-(3,4-dimethylphenyl)-3-oxo-[1,2,4]triazolo[3,4-f]pyridazin-2-yl]-N-phenyl-acetamide 2-[6-(3,4-dimethylphenyl)-3-oxo-…

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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) 3.27 9.91 -26.92 1 7 0 81 373.416 4 ↓

Analogs

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Popular Name: 2-[6-(3,4-dimethylphenyl)-3-oxo-[1,2,4]triazolo[3,4-f]pyridazin-2-yl]-N-(m-tolyl)acetamide 2-[6-(3,4-dimethylphenyl)-3-oxo-…

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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) 3.69 10.56 -26.74 1 7 0 81 387.443 4 ↓

Analogs

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Popular Name: 2-[6-(3,4-dimethylphenyl)-3-oxo-[1,2,4]triazolo[3,4-f]pyridazin-2-yl]-N-(p-tolyl)acetamide 2-[6-(3,4-dimethylphenyl)-3-oxo-…

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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) 3.72 10.56 -26.88 1 7 0 81 387.443 4 ↓

Analogs

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Popular Name: N-(3,5-dimethylphenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo-[1,2,4]triazolo[3,4-f]pyridazin-2-yl]acetamid N-(3,5-dimethylphenyl)-2-[6-(3,4…

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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) 4.10 11.25 -27.04 1 7 0 81 401.47 4 ↓

Analogs

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Popular Name: 2-[6-(3,4-dimethylphenyl)-3-oxo-[1,2,4]triazolo[3,4-f]pyridazin-2-yl]-N-(2,4,6-trimethylphenyl)aceta 2-[6-(3,4-dimethylphenyl)-3-oxo-…

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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) 3.54 12.17 -26.42 1 7 0 81 415.497 4 ↓

Analogs

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Popular Name: N-(2,5-dimethylphenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo-[1,2,4]triazolo[3,4-f]pyridazin-2-yl]acetamid N-(2,5-dimethylphenyl)-2-[6-(3,4…

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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) 4.10 11.41 -26.87 1 7 0 81 401.47 4 ↓

Analogs

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Popular Name: N-(2,6-dimethylphenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo-[1,2,4]triazolo[3,4-f]pyridazin-2-yl]acetamid N-(2,6-dimethylphenyl)-2-[6-(3,4…

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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) 3.13 11.74 -26.69 1 7 0 81 401.47 4 ↓

Analogs

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Popular Name: 2-[6-(3,4-dimethylphenyl)-3-oxo-[1,2,4]triazolo[3,4-f]pyridazin-2-yl]-N-(3-methoxyphenyl)acetamide 2-[6-(3,4-dimethylphenyl)-3-oxo-…

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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) 3.30 9.21 -30.21 1 8 0 91 403.442 5 ↓

Analogs

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Popular Name: N-(3,4-dimethoxyphenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo-[1,2,4]triazolo[3,4-f]pyridazin-2-yl]acetami N-(3,4-dimethoxyphenyl)-2-[6-(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) 2.92 9.12 -29.48 1 9 0 100 433.468 6 ↓

Analogs

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Popular Name: N-(3,5-dimethoxyphenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo-[1,2,4]triazolo[3,4-f]pyridazin-2-yl]acetami N-(3,5-dimethoxyphenyl)-2-[6-(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) 3.31 8.52 -29.85 1 9 0 100 433.468 6 ↓

Analogs

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Popular Name: 2-[6-(3,4-dimethylphenyl)-3-oxo-[1,2,4]triazolo[3,4-f]pyridazin-2-yl]-N-(4-ethoxyphenyl)acetamide 2-[6-(3,4-dimethylphenyl)-3-oxo-…

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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) 3.70 10.11 -27.4 1 8 0 91 417.469 6 ↓

Analogs

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Popular Name: 2-[6-(3,4-dimethylphenyl)-3-oxo-[1,2,4]triazolo[3,4-f]pyridazin-2-yl]-N-(3-methylsulfanylphenyl)acet 2-[6-(3,4-dimethylphenyl)-3-oxo-…

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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) 3.68 10.93 -29.8 1 7 0 81 419.51 5 ↓

Analogs

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Popular Name: N-(4-acetylphenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo-[1,2,4]triazolo[3,4-f]pyridazin-2-yl]acetamide N-(4-acetylphenyl)-2-[6-(3,4-dim…

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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) 3.17 10.31 -29.02 1 8 0 98 415.453 5 ↓

Analogs

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Popular Name: N-(4-cyanophenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo-[1,2,4]triazolo[3,4-f]pyridazin-2-yl]acetamide N-(4-cyanophenyl)-2-[6-(3,4-dime…

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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) 3.02 10.31 -28.62 1 8 0 105 398.426 4 ↓

Analogs

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Popular Name: methyl 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) 3.42 10.56 -34.21 1 9 0 108 431.452 6 ↓

Analogs

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Popular Name: N-(3-chlorophenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo-[1,2,4]triazolo[3,4-f]pyridazin-2-yl]acetamide N-(3-chlorophenyl)-2-[6-(3,4-dim…

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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) 3.92 10.43 -27.97 1 7 0 81 407.861 4 ↓

Analogs

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Popular Name: N-(4-chlorophenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo-[1,2,4]triazolo[3,4-f]pyridazin-2-yl]acetamide N-(4-chlorophenyl)-2-[6-(3,4-dim…

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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) 3.95 10.43 -26.31 1 7 0 81 407.861 4 ↓

Parameters Provided:

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filter.purchasability = annotated
page.format = targets
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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 = 562207 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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