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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-[(S)-(2-methylpyrazol-3-yl)-pyrimidin-2-yl-methyl]propan-1-amine N-[(S)-(2-methylpyrazol-3-yl)-py…

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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) 0.80 4.41 -38.22 2 5 1 60 232.311 5 ↓
Mid Mid (pH 6-8) 0.80 3.15 -8.04 1 5 0 56 231.303 5 ↓

Analogs

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Popular Name: N-[(R)-(2-methylpyrazol-3-yl)-pyrimidin-2-yl-methyl]propan-1-amine N-[(R)-(2-methylpyrazol-3-yl)-py…

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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) 0.80 4.29 -38.35 2 5 1 60 232.311 5 ↓
Mid Mid (pH 6-8) 0.80 3.13 -8.05 1 5 0 56 231.303 5 ↓

Analogs

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Popular Name: (1S)-N-methyl-1-(2-propylpyrazol-3-yl)-1-pyrimidin-2-yl-methanamine (1S)-N-methyl-1-(2-propylpyrazol…

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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) 0.80 3.22 -8.2 1 5 0 56 231.303 5 ↓
Mid Mid (pH 6-8) 0.80 4.52 -38.69 2 5 1 60 232.311 5 ↓

Analogs

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Popular Name: (1R)-N-methyl-1-(2-propylpyrazol-3-yl)-1-pyrimidin-2-yl-methanamine (1R)-N-methyl-1-(2-propylpyrazol…

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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) 0.80 3.05 -8.13 1 5 0 56 231.303 5 ↓
Mid Mid (pH 6-8) 0.80 4.34 -39.98 2 5 1 60 232.311 5 ↓

Analogs

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Popular Name: N-[(S)-(2-propylpyrazol-3-yl)-pyrimidin-2-yl-methyl]ethanamine N-[(S)-(2-propylpyrazol-3-yl)-py…

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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 5.38 -36.51 2 5 1 60 246.338 6 ↓
Mid Mid (pH 6-8) 1.18 3.63 -7.44 1 5 0 56 245.33 6 ↓

Analogs

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Popular Name: N-[(R)-(2-propylpyrazol-3-yl)-pyrimidin-2-yl-methyl]ethanamine N-[(R)-(2-propylpyrazol-3-yl)-py…

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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 5.18 -37.77 2 5 1 60 246.338 6 ↓
Mid Mid (pH 6-8) 1.18 3.95 -8.44 1 5 0 56 245.33 6 ↓

Analogs

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Popular Name: N-[(S)-(2-ethylpyrazol-3-yl)-pyrimidin-2-yl-methyl]ethanamine N-[(S)-(2-ethylpyrazol-3-yl)-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) 0.68 4.5 -37.56 2 5 1 60 232.311 5 ↓
Mid Mid (pH 6-8) 0.68 3.14 -8.56 1 5 0 56 231.303 5 ↓

Analogs

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Popular Name: N-[(R)-(2-ethylpyrazol-3-yl)-pyrimidin-2-yl-methyl]ethanamine N-[(R)-(2-ethylpyrazol-3-yl)-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) 0.68 3.8 -37.76 2 5 1 60 232.311 5 ↓
Mid Mid (pH 6-8) 0.68 2.95 -7.49 1 5 0 56 231.303 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(S)-(2-propylpyrazol-3-yl)-pyrimidin-2-yl-methyl]propan-1-amine N-[(S)-(2-propylpyrazol-3-yl)-py…

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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) 1.68 5.94 -38.24 2 5 1 60 260.365 7 ↓
Mid Mid (pH 6-8) 1.68 4.84 -8.5 1 5 0 56 259.357 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(R)-(2-propylpyrazol-3-yl)-pyrimidin-2-yl-methyl]propan-1-amine N-[(R)-(2-propylpyrazol-3-yl)-py…

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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) 1.68 5.13 -38.27 2 5 1 60 260.365 7 ↓
Mid Mid (pH 6-8) 1.68 4.37 -7.35 1 5 0 56 259.357 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(S)-(2-ethylpyrazol-3-yl)-pyrimidin-2-yl-methyl]propan-1-amine N-[(S)-(2-ethylpyrazol-3-yl)-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) 1.18 5.26 -38.08 2 5 1 60 246.338 6 ↓
Mid Mid (pH 6-8) 1.18 4.11 -8.57 1 5 0 56 245.33 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(R)-(2-ethylpyrazol-3-yl)-pyrimidin-2-yl-methyl]propan-1-amine N-[(R)-(2-ethylpyrazol-3-yl)-pyr…

Find On: PubMed — Wikipedia — Google

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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 4.71 -38.22 2 5 1 60 246.338 6 ↓
Mid Mid (pH 6-8) 1.18 3.79 -7.34 1 5 0 56 245.33 6 ↓

Parameters Provided:

ring.id = 343077
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 = 343077 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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