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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-isopropyl-5-(3-methylpyrazol-1-yl)pyrimidine-4-carboxylic 2-isopropyl-5-(3-methylpyrazol-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) 1.48 6.48 -56.97 0 6 -1 84 245.262 3 ↓

Analogs

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Popular Name: 2-isopropyl-5-(3-isopropylpyrazol-1-yl)pyrimidine-4-carboxylic 2-isopropyl-5-(3-isopropylpyrazo…

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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) 2.54 7.75 -57.86 0 6 -1 84 273.316 4 ↓

Analogs

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Popular Name: [2-isopropyl-5-(3-methylpyrazol-1-yl)pyrimidin-4-yl]methanol [2-isopropyl-5-(3-methylpyrazol-…

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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) 1.25 3.06 -9.23 1 5 0 64 232.287 3 ↓

Analogs

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Popular Name: [2-isopropyl-5-(3-isopropylpyrazol-1-yl)pyrimidin-4-yl]methanol [2-isopropyl-5-(3-isopropylpyraz…

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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) 2.30 4.33 -8.8 1 5 0 64 260.341 4 ↓

Analogs

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Popular Name: 4-(chloromethyl)-2-isopropyl-5-(3-methylpyrazol-1-yl)pyrimidine 4-(chloromethyl)-2-isopropyl-5-(…

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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) 2.48 6.98 -6.92 0 4 0 44 250.733 3 ↓

Analogs

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Popular Name: 4-(chloromethyl)-2-isopropyl-5-(3-isopropylpyrazol-1-yl)pyrimidine 4-(chloromethyl)-2-isopropyl-5-(…

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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 8.25 -6.65 0 4 0 44 278.787 4 ↓

Analogs

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Popular Name: [2-isopropyl-5-(3-methylpyrazol-1-yl)pyrimidin-4-yl]methanamine [2-isopropyl-5-(3-methylpyrazol-…

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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) 1.09 3.45 -6.59 2 5 0 70 231.303 3 ↓
Mid Mid (pH 6-8) 1.09 3.87 -36.23 3 5 1 71 232.311 3 ↓

Analogs

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Popular Name: 1-[2-isopropyl-5-(3-methylpyrazol-1-yl)pyrimidin-4-yl]-N-methyl-methanamine 1-[2-isopropyl-5-(3-methylpyrazo…

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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 4.26 -6.43 1 5 0 56 245.33 4 ↓
Mid Mid (pH 6-8) 1.47 5.75 -31.77 2 5 1 60 246.338 4 ↓

Analogs

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Popular Name: N-[[2-isopropyl-5-(3-methylpyrazol-1-yl)pyrimidin-4-yl]methyl]ethanamine N-[[2-isopropyl-5-(3-methylpyraz…

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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) 1.84 6.61 -30.42 2 5 1 60 260.365 5 ↓
Mid Mid (pH 6-8) 1.84 5.19 -6.27 1 5 0 56 259.357 5 ↓

Analogs

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Popular Name: N-[[2-isopropyl-5-(3-methylpyrazol-1-yl)pyrimidin-4-yl]methyl]propan-1-amine N-[[2-isopropyl-5-(3-methylpyraz…

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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) 2.35 7.36 -30.8 2 5 1 60 274.392 6 ↓
Mid Mid (pH 6-8) 2.35 5.96 -6.08 1 5 0 56 273.384 6 ↓

Analogs

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Popular Name: N-[[2-isopropyl-5-(3-methylpyrazol-1-yl)pyrimidin-4-yl]methyl]propan-2-amine N-[[2-isopropyl-5-(3-methylpyraz…

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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) 2.14 7.13 -28.6 2 5 1 60 274.392 5 ↓
Mid Mid (pH 6-8) 2.14 5.91 -5.8 1 5 0 56 273.384 5 ↓

Analogs

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Popular Name: N-[[2-isopropyl-5-(3-methylpyrazol-1-yl)pyrimidin-4-yl]methyl]-2-methyl-propan-2-amine N-[[2-isopropyl-5-(3-methylpyraz…

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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) 2.65 7.54 -27.29 2 5 1 60 288.419 5 ↓
Mid Mid (pH 6-8) 2.65 6.29 -5.72 1 5 0 56 287.411 5 ↓

Analogs

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Popular Name: N-[[2-isopropyl-5-(3-methylpyrazol-1-yl)pyrimidin-4-yl]methyl]-2-methyl-propan-1-amine N-[[2-isopropyl-5-(3-methylpyraz…

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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) 2.59 8.04 -30.5 2 5 1 60 288.419 6 ↓
Mid Mid (pH 6-8) 2.59 6.65 -6.03 1 5 0 56 287.411 6 ↓

Analogs

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Popular Name: [2-isopropyl-5-(3-isopropylpyrazol-1-yl)pyrimidin-4-yl]methanamine [2-isopropyl-5-(3-isopropylpyraz…

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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) 2.15 4.66 -6.24 2 5 0 70 259.357 4 ↓
Mid Mid (pH 6-8) 2.15 5.14 -36.14 3 5 1 71 260.365 4 ↓

Analogs

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Popular Name: 1-[2-isopropyl-5-(3-isopropylpyrazol-1-yl)pyrimidin-4-yl]-N-methyl-methanamine 1-[2-isopropyl-5-(3-isopropylpyr…

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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) 2.52 5.53 -6.09 1 5 0 56 273.384 5 ↓
Mid Mid (pH 6-8) 2.52 7.01 -31.67 2 5 1 60 274.392 5 ↓

Analogs

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Popular Name: N-[[2-isopropyl-5-(3-isopropylpyrazol-1-yl)pyrimidin-4-yl]methyl]ethanamine N-[[2-isopropyl-5-(3-isopropylpy…

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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) 2.90 7.87 -30.24 2 5 1 60 288.419 6 ↓
Mid Mid (pH 6-8) 2.90 6.46 -5.92 1 5 0 56 287.411 6 ↓

Analogs

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Popular Name: 5-(3-carbamoylpyrazol-1-yl)-2-isopropyl-pyrimidine-4-carboxylic 5-(3-carbamoylpyrazol-1-yl)-2-is…

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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 2.52 -53.39 2 8 -1 127 274.26 4 ↓

Analogs

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Popular Name: 2-isopropyl-5-[3-(methylcarbamoyl)pyrazol-1-yl]pyrimidine-4-carboxylic 2-isopropyl-5-[3-(methylcarbamoy…

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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) 0.69 4.01 -54.45 1 8 -1 113 288.287 4 ↓

Analogs

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Popular Name: 5-(4-carbamoylpyrazol-1-yl)-2-isopropyl-pyrimidine-4-carboxylic 5-(4-carbamoylpyrazol-1-yl)-2-is…

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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) 0.01 2.54 -57.39 2 8 -1 127 274.26 4 ↓

Parameters Provided:

ring.id = 28567
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 = 28567 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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