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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

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Popular Name: 4-bromo-2-ethyl-N-[2-(4-nitropyrazol-1-yl)ethyl]pyrazole-3-carboxamide 4-bromo-2-ethyl-N-[2-(4-nitropyr…

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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) 0.89 -1.01 -17.8 1 9 0 110 357.168 6 ↓

Analogs

2776641
2776641

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Popular Name: 4-bromo-N-[2-(4-chloropyrazol-1-yl)ethyl]-2-ethyl-pyrazole-3-carboxamide 4-bromo-N-[2-(4-chloropyrazol-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) 1.61 -1.67 -13.54 1 6 0 64 346.616 5 ↓

Analogs

2776641
2776641

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Popular Name: 4-bromo-N-[2-(4-bromopyrazol-1-yl)ethyl]-2-ethyl-pyrazole-3-carboxamide 4-bromo-N-[2-(4-bromopyrazol-1-y…

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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) 1.74 4.32 -13.5 1 6 0 65 391.067 5 ↓

Analogs

13959803
13959803
2537358
2537358
2537869
2537869

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Popular Name: 2-ethyl-4-nitro-N-[2-(4-nitropyrazol-1-yl)ethyl]pyrazole-3-carboxamide 2-ethyl-4-nitro-N-[2-(4-nitropyr…

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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) 0.04 4.47 -21.7 1 12 0 156 323.269 7 ↓

Analogs

2782606
2782606

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Popular Name: N-[(1S)-2,2-dimethyl-1-(pyrazol-1-ylmethyl)propyl]-2-methyl-4-nitro-pyrazole-3-carboxamide N-[(1S)-2,2-dimethyl-1-(pyrazol-…

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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 1.68 -16.23 1 9 0 110 320.353 6 ↓

Analogs

2782605
2782605

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Popular Name: N-[(1R)-2,2-dimethyl-1-(pyrazol-1-ylmethyl)propyl]-2-methyl-4-nitro-pyrazole-3-carboxamide N-[(1R)-2,2-dimethyl-1-(pyrazol-…

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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 1.21 -18.99 1 9 0 110 320.353 6 ↓

Analogs

2786352
2786352

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Popular Name: N-[(1S)-2,2-dimethyl-1-(pyrazol-1-ylmethyl)propyl]-2-methyl-pyrazole-3-carboxamide N-[(1S)-2,2-dimethyl-1-(pyrazol-…

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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) 1.58 1.42 -11.06 1 6 0 64 275.356 5 ↓

Analogs

2786351
2786351

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Popular Name: N-[(1R)-2,2-dimethyl-1-(pyrazol-1-ylmethyl)propyl]-2-methyl-pyrazole-3-carboxamide N-[(1R)-2,2-dimethyl-1-(pyrazol-…

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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) 1.58 0.91 -14.11 1 6 0 64 275.356 5 ↓

Analogs

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Popular Name: 2-ethyl-5-methyl-N-(2-pyrazol-1-ylethyl)pyrazole-3-carboxamide 2-ethyl-5-methyl-N-(2-pyrazol-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) 0.49 3.79 -14.39 1 6 0 65 247.302 5 ↓

Analogs

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Popular Name: N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-ethyl-5-methyl-pyrazole-3-carboxamide N-[2-(3,5-dimethylpyrazol-1-yl)e…

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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) 0.93 4.85 -13.74 1 6 0 65 275.356 5 ↓

Analogs

2780618
2780618
36613978
36613978

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Popular Name: N-[2-(4-chloropyrazol-1-yl)ethyl]-2-ethyl-5-methyl-pyrazole-3-carboxamide N-[2-(4-chloropyrazol-1-yl)ethyl…

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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) 1.10 4.29 -13.97 1 6 0 65 281.747 5 ↓

Analogs

40771183
40771183
2780618
2780618
36613978
36613978

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Popular Name: 4-chloro-2-ethyl-5-methyl-N-(2-pyrazol-1-ylethyl)pyrazole-3-carboxamide 4-chloro-2-ethyl-5-methyl-N-(2-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) 1.10 4.21 -13.89 1 6 0 65 281.747 5 ↓

Analogs

36613978
36613978

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Popular Name: 4-chloro-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-ethyl-5-methyl-pyrazole-3-carboxamide 4-chloro-N-[2-(3,5-dimethylpyraz…

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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) 1.54 5.27 -14.5 1 6 0 65 309.801 5 ↓

Analogs

2780618
2780618
36613978
36613978
40771179
40771179

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-N-[2-(4-chloropyrazol-1-yl)ethyl]-2-ethyl-5-methyl-pyrazole-3-carboxamide 4-chloro-N-[2-(4-chloropyrazol-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) 1.70 4.72 -13.44 1 6 0 65 316.192 5 ↓

Parameters Provided:

ring.id = 233924
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 = 233924 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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