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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-[(1S)-1-(2-methylpyrazol-3-yl)-2-(2-thienyl)ethyl]propan-1-amine N-[(1S)-1-(2-methylpyrazol-3-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) 2.95 6.74 -40.89 2 3 1 34 250.391 6 ↓
Hi High (pH 8-9.5) 2.95 5.91 -5.19 1 3 0 30 249.383 6 ↓

Analogs

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Popular Name: N-[(1R)-1-(2-methylpyrazol-3-yl)-2-(2-thienyl)ethyl]propan-1-amine N-[(1R)-1-(2-methylpyrazol-3-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) 2.95 6.97 -38.2 2 3 1 34 250.391 6 ↓
Hi High (pH 8-9.5) 2.95 5.92 -5.56 1 3 0 30 249.383 6 ↓

Analogs

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Popular Name: (1R)-N-methyl-1-(2-propylpyrazol-3-yl)-2-(2-thienyl)ethanamine (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) 2.95 6.91 -39.47 2 3 1 34 250.391 6 ↓
Hi High (pH 8-9.5) 2.95 5.27 -5.14 1 3 0 30 249.383 6 ↓

Analogs

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Popular Name: (1S)-N-methyl-1-(2-propylpyrazol-3-yl)-2-(2-thienyl)ethanamine (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) 2.95 6.67 -48.51 2 3 1 34 250.391 6 ↓
Hi High (pH 8-9.5) 2.95 5.84 -5.11 1 3 0 30 249.383 6 ↓

Analogs

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Popular Name: (1R)-N-ethyl-1-(2-propylpyrazol-3-yl)-2-(2-thienyl)ethanamine (1R)-N-ethyl-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) 3.33 7.75 -37.71 2 3 1 34 264.418 7 ↓
Hi High (pH 8-9.5) 3.33 6.18 -4.89 1 3 0 30 263.41 7 ↓

Analogs

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Popular Name: (1S)-N-ethyl-1-(2-propylpyrazol-3-yl)-2-(2-thienyl)ethanamine (1S)-N-ethyl-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) 3.33 7.8 -42.64 2 3 1 34 264.418 7 ↓
Hi High (pH 8-9.5) 3.33 6.78 -4.91 1 3 0 30 263.41 7 ↓

Analogs

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Popular Name: (1S)-N-ethyl-1-(2-ethylpyrazol-3-yl)-2-(2-thienyl)ethanamine (1S)-N-ethyl-1-(2-ethylpyrazol-3…

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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) 2.82 6.67 -42.54 2 3 1 34 250.391 6 ↓
Hi High (pH 8-9.5) 2.82 5.93 -4.99 1 3 0 30 249.383 6 ↓

Analogs

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Popular Name: (1R)-N-ethyl-1-(2-ethylpyrazol-3-yl)-2-(2-thienyl)ethanamine (1R)-N-ethyl-1-(2-ethylpyrazol-3…

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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) 2.82 7.07 -37.56 2 3 1 34 250.391 6 ↓
Hi High (pH 8-9.5) 2.82 5.36 -5.36 1 3 0 30 249.383 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-1-(2-propylpyrazol-3-yl)-2-(2-thienyl)ethyl]propan-1-amine N-[(1S)-1-(2-propylpyrazol-3-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) 3.83 8.19 -42.99 2 3 1 34 278.445 8 ↓
Hi High (pH 8-9.5) 3.83 7.44 -4.62 1 3 0 30 277.437 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R)-1-(2-propylpyrazol-3-yl)-2-(2-thienyl)ethyl]propan-1-amine N-[(1R)-1-(2-propylpyrazol-3-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) 3.83 8.59 -38.11 2 3 1 34 278.445 8 ↓
Hi High (pH 8-9.5) 3.83 6.9 -4.99 1 3 0 30 277.437 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-1-(2-ethylpyrazol-3-yl)-2-(2-thienyl)ethyl]propan-1-amine N-[(1S)-1-(2-ethylpyrazol-3-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) 3.33 7.43 -42.95 2 3 1 34 264.418 7 ↓
Hi High (pH 8-9.5) 3.33 6.68 -4.92 1 3 0 30 263.41 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R)-1-(2-ethylpyrazol-3-yl)-2-(2-thienyl)ethyl]propan-1-amine N-[(1R)-1-(2-ethylpyrazol-3-yl)-…

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) 3.33 7.84 -38.15 2 3 1 34 264.418 7 ↓
Hi High (pH 8-9.5) 3.33 6.15 -5.27 1 3 0 30 263.41 7 ↓

Parameters Provided:

ring.id = 343159
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 = 343159 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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