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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: N,N-diethyl-2-[1-(4-fluorophenyl)-4-hydroxy-6-oxo-pyrimidin-2-yl]sulfanyl-acetamide N,N-diethyl-2-[1-(4-fluorophenyl…

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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) 2.11 5.34 -14.94 1 6 0 75 351.403 6 ↓

Analogs

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Popular Name: N,N-diethyl-2-[1-(2-fluorophenyl)-4-hydroxy-6-oxo-pyrimidin-2-yl]sulfanyl-acetamide N,N-diethyl-2-[1-(2-fluorophenyl…

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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) 2.27 6.13 -55.12 0 6 -1 78 350.395 6 ↓
Lo Low (pH 4.5-6) 2.27 7.01 -32.83 1 6 0 80 351.403 6 ↓

Analogs

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Popular Name: 2-chloro-5-[2,4-dioxo-6-(trifluoromethyl)-1H-pyrimidin-3-yl]-4-fluoro-N,N-dimethyl-benzenesulfonamid 2-chloro-5-[2,4-dioxo-6-(trifluo…

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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) 2.69 1.7 -40.64 0 7 -1 95 414.744 4 ↓
Lo Low (pH 4.5-6) 2.23 3.54 -12.41 1 7 0 92 415.752 4 ↓

Analogs

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Popular Name: 3-(2-chlorophenyl)-6-(trifluoromethyl)-2,4(1H,3H)-pyrimidinedione 3-(2-chlorophenyl)-6-(trifluorom…

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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) 3.10 4.16 -39.2 0 4 -1 58 289.62 2 ↓

Analogs

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Popular Name: 3-(3-chlorophenyl)-6-(trifluoromethyl)-2,4(1H,3H)-pyrimidinedione 3-(3-chlorophenyl)-6-(trifluorom…

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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) 3.12 3.84 -36.17 0 4 -1 58 289.62 2 ↓

Analogs

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Popular Name: 6-(trifluoromethyl)-3-[3-(trifluoromethyl)phenyl]-2,4(1H,3H)-pyrimidinedione 6-(trifluoromethyl)-3-[3-(triflu…

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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) 3.34 4.34 -35.84 0 4 -1 58 323.172 3 ↓

Analogs

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Popular Name: 2-[5-ethyl-4-hydroxy-1-(4-methoxyphenyl)-6-oxo-pyrimidin-2-yl]sulfanyl-N-methyl-acetamide 2-[5-ethyl-4-hydroxy-1-(4-methox…

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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) 1.85 2.81 -50.78 1 7 -1 96 348.404 6 ↓
Lo Low (pH 4.5-6) 1.85 3.75 -27.34 2 7 0 98 349.412 6 ↓

Analogs

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Popular Name: 2-[5-ethyl-4-hydroxy-1-(4-methoxyphenyl)-6-oxo-pyrimidin-2-yl]sulfanylacetamide 2-[5-ethyl-4-hydroxy-1-(4-methox…

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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) 1.47 1.33 -50.68 2 7 -1 110 334.377 6 ↓
Lo Low (pH 4.5-6) 1.47 2.26 -27.84 3 7 0 112 335.385 6 ↓

Analogs

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Popular Name: 2-[4-hydroxy-1-(o-tolyl)-6-oxo-pyrimidin-2-yl]sulfanyl-N-isopropyl-acetamide 2-[4-hydroxy-1-(o-tolyl)-6-oxo-p…

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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) 2.23 4.62 -54.73 1 6 -1 87 332.405 5 ↓
Lo Low (pH 4.5-6) 2.23 5.55 -28.24 2 6 0 88 333.413 5 ↓

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) 1.76 3.76 -50.49 0 7 -1 93 321.334 6 ↓
Lo Low (pH 4.5-6) 1.76 4.7 -26.85 1 7 0 95 322.342 6 ↓

Analogs

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Popular Name: N-allyl-2-[4-hydroxy-1-(o-tolyl)-6-oxo-pyrimidin-2-yl]sulfanyl-acetamide N-allyl-2-[4-hydroxy-1-(o-tolyl)…

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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) 2.21 4.37 -54.3 1 6 -1 87 330.389 6 ↓
Lo Low (pH 4.5-6) 2.21 5.3 -28.22 2 6 0 88 331.397 6 ↓

Parameters Provided:

ring.id = 146590
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 = 146590 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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