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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: ethyl 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) 3.59 10.1 -15.73 1 5 0 60 369.248 6 ↓

Analogs

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Popular Name: 2-[3,4-bis(methylsulfamoyl)pyrrol-1-yl]-N-(5-chloro-2-methyl-phenyl)acetamide 2-[3,4-bis(methylsulfamoyl)pyrro…

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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) 0.77 1.05 -25.46 3 9 0 126 434.927 7 ↓
Hi High (pH 8-9.5) 0.77 0.5 -59.81 2 9 -1 128 433.919 7 ↓

Analogs

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Popular Name: N-(4-chlorophenyl)-2-(2,3,4-trimethylpyrrol-1-yl)acetamide N-(4-chlorophenyl)-2-(2,3,4-trim…

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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) 3.38 8.86 -12.47 1 3 0 34 276.767 3 ↓

Analogs

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Popular Name: N-(2-bromophenyl)-2-(2,3,4-trimethylpyrrol-1-yl)acetamide N-(2-bromophenyl)-2-(2,3,4-trime…

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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) 3.46 9.11 -10.03 1 3 0 34 321.218 3 ↓

Analogs

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Popular Name: N-(m-tolyl)-2-(2,3,4-trimethylpyrrol-1-yl)acetamide N-(m-tolyl)-2-(2,3,4-trimethylpy…

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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) 3.12 8.97 -12.5 1 3 0 34 256.349 3 ↓

Analogs

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Popular Name: N-(3-chlorophenyl)-2-(2,3,4-trimethylpyrrol-1-yl)acetamide N-(3-chlorophenyl)-2-(2,3,4-trim…

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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) 3.35 8.86 -14.18 1 3 0 34 276.767 3 ↓

Analogs

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Popular Name: N-(2-chlorophenyl)-2-(2,3,4-trimethylpyrrol-1-yl)acetamide N-(2-chlorophenyl)-2-(2,3,4-trim…

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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 8.97 -10.2 1 3 0 34 276.767 3 ↓

Analogs

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Popular Name: N-(2-fluorophenyl)-2-(2,3,4-trimethylpyrrol-1-yl)acetamide N-(2-fluorophenyl)-2-(2,3,4-trim…

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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) 2.81 8.44 -10.66 1 3 0 34 260.312 3 ↓

Analogs

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Popular Name: N-phenyl-2-(2,3,4-trimethylpyrrol-1-yl)acetamide N-phenyl-2-(2,3,4-trimethylpyrro…

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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) 2.70 8.34 -12.55 1 3 0 34 242.322 3 ↓

Analogs

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Popular Name: N-(2-methoxyphenyl)-2-(2,3,4-trimethylpyrrol-1-yl)acetamide N-(2-methoxyphenyl)-2-(2,3,4-tri…

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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) 2.71 7.75 -11.83 1 4 0 43 272.348 4 ↓

Analogs

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Popular Name: N-(p-tolyl)-2-(2,3,4-trimethylpyrrol-1-yl)acetamide N-(p-tolyl)-2-(2,3,4-trimethylpy…

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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) 3.15 8.97 -12.62 1 3 0 34 256.349 3 ↓

Analogs

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Popular Name: N-(3-methoxyphenyl)-2-(2,3,4-trimethylpyrrol-1-yl)acetamide N-(3-methoxyphenyl)-2-(2,3,4-tri…

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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) 2.73 7.64 -15.93 1 4 0 43 272.348 4 ↓

Analogs

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Popular Name: N-(4-bromophenyl)-2-(2,3,4-trimethylpyrrol-1-yl)acetamide N-(4-bromophenyl)-2-(2,3,4-trime…

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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) 3.51 8.97 -12.48 1 3 0 34 321.218 3 ↓

Analogs

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Popular Name: N-(o-tolyl)-2-(2,3,4-trimethylpyrrol-1-yl)acetamide N-(o-tolyl)-2-(2,3,4-trimethylpy…

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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) 3.10 9.19 -12.54 1 3 0 34 256.349 3 ↓

Analogs

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Popular Name: N-(3-fluorophenyl)-2-(2,3,4-trimethylpyrrol-1-yl)acetamide N-(3-fluorophenyl)-2-(2,3,4-trim…

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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) 2.84 8.41 -15.44 1 3 0 34 260.312 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-fluorophenyl)-2-(2,3,4-trimethylpyrrol-1-yl)acetamide N-(4-fluorophenyl)-2-(2,3,4-trim…

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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) 2.86 8.41 -13.13 1 3 0 34 260.312 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-bromophenyl)-2-(2,3,4-trimethylpyrrol-1-yl)acetamide N-(3-bromophenyl)-2-(2,3,4-trime…

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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) 3.48 8.97 -14.03 1 3 0 34 321.218 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-methoxyphenyl)-2-(2,3,4-trimethylpyrrol-1-yl)acetamide N-(4-methoxyphenyl)-2-(2,3,4-tri…

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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) 2.75 7.63 -13.38 1 4 0 43 272.348 4 ↓

Parameters Provided:

ring.id = 80670
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 = 80670 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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