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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: (5R)-5-methyl-6-[4-(4-oxo-1-pyridyl)phenyl]-4,5-dihydro-2H-1,2,4-triazin-3-one (5R)-5-methyl-6-[4-(4-oxo-1-pyri…

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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 4.45 -23.09 2 6 0 75 282.303 2 ↓

Analogs

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Popular Name: (5S)-5-methyl-6-[4-(4-oxo-1-pyridyl)phenyl]-4,5-dihydro-2H-1,2,4-triazin-3-one (5S)-5-methyl-6-[4-(4-oxo-1-pyri…

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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 4.48 -23.07 2 6 0 75 282.303 2 ↓

Analogs

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Popular Name: N-[2-chloro-4-[(5R)-5-methyl-3-oxo-4,5-dihydro-2H-1,2,4-triazin-6-yl]phenoxy]-N-(3-ethoxypropyl)acet N-[2-chloro-4-[(5R)-5-methyl-3-o…

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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) 2.10 4.67 -14.47 2 8 0 92 382.848 8 ↓

Analogs

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Popular Name: N-[2-chloro-4-[(5S)-5-methyl-3-oxo-4,5-dihydro-2H-1,2,4-triazin-6-yl]phenoxy]-N-(3-ethoxypropyl)acet N-[2-chloro-4-[(5S)-5-methyl-3-o…

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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) 2.10 4.63 -14.43 2 8 0 92 382.848 8 ↓

Analogs

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Popular Name: N-[2-chloro-4-[(5R)-5-methyl-3-oxo-4,5-dihydro-2H-1,2,4-triazin-6-yl]phenoxy]-N-isobutyl-acetamide N-[2-chloro-4-[(5R)-5-methyl-3-o…

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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) 2.60 4.86 -14.85 2 7 0 83 352.822 5 ↓

Analogs

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Popular Name: N-[2-chloro-4-[(5S)-5-methyl-3-oxo-4,5-dihydro-2H-1,2,4-triazin-6-yl]phenoxy]-N-isobutyl-acetamide N-[2-chloro-4-[(5S)-5-methyl-3-o…

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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) 2.60 4.87 -12.72 2 7 0 83 352.822 5 ↓

Analogs

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Popular Name: N-[2-chloro-4-(3-oxo-4,5-dihydro-2H-1,2,4-triazin-6-yl)phenoxy]-N-(2-morpholinoethyl)acetamide N-[2-chloro-4-(3-oxo-4,5-dihydro…

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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) 1.02 1.76 -14.92 2 9 0 96 395.847 6 ↓
Mid Mid (pH 6-8) 1.02 3.97 -44.01 3 9 1 97 396.855 6 ↓

Analogs

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Popular Name: N-[2-chloro-4-(3-oxo-4,5-dihydro-2H-1,2,4-triazin-6-yl)phenoxy]-N-phenethyl-acetamide N-[2-chloro-4-(3-oxo-4,5-dihydro…

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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) 2.95 7.06 -14.31 2 7 0 83 386.839 6 ↓

Analogs

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Popular Name: N-[2-chloro-4-[(5R)-5-methyl-3-oxo-4,5-dihydro-2H-1,2,4-triazin-6-yl]phenoxy]-N-(2-ethoxyethyl)aceta N-[2-chloro-4-[(5R)-5-methyl-3-o…

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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) 1.83 3.93 -13.4 2 8 0 92 368.821 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-chloro-4-[(5S)-5-methyl-3-oxo-4,5-dihydro-2H-1,2,4-triazin-6-yl]phenoxy]-N-(2-ethoxyethyl)aceta N-[2-chloro-4-[(5S)-5-methyl-3-o…

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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) 1.83 3.9 -13.38 2 8 0 92 368.821 7 ↓

Analogs

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Popular Name: 2-(methylamino)-4-(3-pyridyl)-5H-1,2,4-triazin-3-one 2-(methylamino)-4-(3-pyridyl)-5H…

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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) 0.32 2.57 -14.5 1 6 0 61 205.221 2 ↓

Parameters Provided:

ring.id = 74444
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 = 74444 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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