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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

5055933
5055933

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(1,3,4-trimethyl-2,6-dioxo-pyrimidin-5-yl)sulfonylpiperidine-4-carboxamide 1-(1,3,4-trimethyl-2,6-dioxo-pyr…

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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) -1.57 0.56 -20.3 2 9 0 124 344.393 3 ↓

Analogs

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Popular Name: (3R)-1-(1,3-dimethyl-2,4-dioxo-pyrimidin-5-yl)sulfonyl-N-ethyl-piperidine-3-carboxamide (3R)-1-(1,3-dimethyl-2,4-dioxo-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) -1.05 2.39 -23.89 1 9 0 110 358.42 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-1-(1,3-dimethyl-2,4-dioxo-pyrimidin-5-yl)sulfonyl-N-ethyl-piperidine-3-carboxamide (3S)-1-(1,3-dimethyl-2,4-dioxo-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) -1.05 2.46 -23.92 1 9 0 110 358.42 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(2,4-dioxo-1H-pyrimidin-5-yl)sulfonyl]-4-methyl-piperidine-4-carboxylic 1-[(2,4-dioxo-1H-pyrimidin-5-yl)…

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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) -1.17 0.25 -58.5 2 9 -1 143 316.315 3 ↓
Mid Mid (pH 6-8) -0.72 -2.51 -114.85 1 9 -2 146 315.307 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-1-[(2,4-dioxo-1H-pyrimidin-5-yl)sulfonyl]-3-methyl-piperidine-3-carboxylic (3S)-1-[(2,4-dioxo-1H-pyrimidin-…

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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) -1.17 0.61 -65.02 2 9 -1 143 316.315 3 ↓
Mid Mid (pH 6-8) -0.72 -2.2 -97.89 1 9 -2 146 315.307 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-1-[(2,4-dioxo-1H-pyrimidin-5-yl)sulfonyl]-3-methyl-piperidine-3-carboxylic (3R)-1-[(2,4-dioxo-1H-pyrimidin-…

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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) -1.17 0.19 -65.53 2 9 -1 143 316.315 3 ↓
Mid Mid (pH 6-8) -0.72 -2.37 -97.15 1 9 -2 146 315.307 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-[[4-(2-aminoethyl)-1-piperidyl]sulfonyl]-1H-pyrimidine-2,4-dione 5-[[4-(2-aminoethyl)-1-piperidyl…

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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 -2.08 -57.85 5 8 1 131 303.364 4 ↓
Mid Mid (pH 6-8) -0.95 -3.82 -72.35 4 8 0 134 302.356 4 ↓
Mid Mid (pH 6-8) -0.95 -4.68 -82.28 4 8 0 134 302.356 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-[[4-[2-(methylamino)ethyl]-1-piperidyl]sulfonyl]-1H-pyrimidine-2,4-dione 5-[[4-[2-(methylamino)ethyl]-1-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) -0.43 -0.01 -55.9 4 8 1 120 317.391 5 ↓
Mid Mid (pH 6-8) 0.03 -2.82 -77.28 3 8 0 123 316.383 5 ↓

Parameters Provided:

ring.id = 99972
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 = 99972 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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