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

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Popular Name: 2-(3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-[2-(3-methylphenoxy)ethyl]acetamide 2-(3-methyl-6,8-dihydro-5H-[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) 1.03 5.52 -21.43 1 7 0 72 329.404 6 ↓
Mid Mid (pH 6-8) 1.03 7.7 -59.03 2 7 1 73 330.412 6 ↓

Analogs

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Popular Name: 2-(3-ethyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-(2-phenoxyethyl)acetamide 2-(3-ethyl-6,8-dihydro-5H-[1,2,4…

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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) 1.18 5.44 -21.13 1 7 0 72 329.404 7 ↓
Mid Mid (pH 6-8) 1.18 7.61 -59.08 2 7 1 73 330.412 7 ↓

Analogs

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Popular Name: N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-(3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl) N-[2-(2-fluorophenoxy)ethyl]-N-m…

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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 7.03 -20.65 0 7 0 63 347.394 6 ↓
Mid Mid (pH 6-8) 0.47 9.21 -57.86 1 7 1 65 348.402 6 ↓

Analogs

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Popular Name: N-[2-(3-chlorophenoxy)ethyl]-2-(3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)acetamide N-[2-(3-chlorophenoxy)ethyl]-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) 1.26 5.35 -22.04 1 7 0 72 349.822 6 ↓
Mid Mid (pH 6-8) 1.26 7.53 -60.14 2 7 1 73 350.83 6 ↓

Analogs

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Popular Name: 2-(3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-(2-phenoxyethyl)acetamide 2-(3-methyl-6,8-dihydro-5H-[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) 0.61 4.83 -21.39 1 7 0 72 315.377 6 ↓
Mid Mid (pH 6-8) 0.61 7.01 -59.05 2 7 1 73 316.385 6 ↓

Analogs

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Popular Name: 2-(3-isopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-(2-phenoxyethyl)acetamide 2-(3-isopropyl-6,8-dihydro-5H-[1…

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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) 1.66 5.88 -20.77 1 7 0 72 343.431 7 ↓
Mid Mid (pH 6-8) 1.66 8.04 -58.81 2 7 1 73 344.439 7 ↓

Parameters Provided:

ring.id = 339210
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 = 339210 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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