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ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 2-(4,4-diethyl-2,5-dioxo-imidazolidin-1-yl)-N-[2-(4-methoxyphenyl)ethyl]acetamide 2-(4,4-diethyl-2,5-dioxo-imidazo…

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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) 2.46 5.07 -20.61 2 7 0 88 347.415 8 ↓

Analogs

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Popular Name: N-[2-(4-fluorophenyl)ethyl]-2-[(4S)-4-isobutyl-2,5-dioxo-imidazolidin-1-yl]acetamide N-[2-(4-fluorophenyl)ethyl]-2-[(…

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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) 2.39 5.54 -19.17 2 6 0 79 335.379 7 ↓

Analogs

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Popular Name: N-[2-(4-fluorophenyl)ethyl]-2-[(4R)-4-isobutyl-2,5-dioxo-imidazolidin-1-yl]acetamide N-[2-(4-fluorophenyl)ethyl]-2-[(…

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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) 2.39 5.51 -19.79 2 6 0 79 335.379 7 ↓

Analogs

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Popular Name: 2-(2,5-dioxo-4,4-dipropyl-imidazolidin-1-yl)-N-[2-(4-methoxyphenyl)ethyl]acetamide 2-(2,5-dioxo-4,4-dipropyl-imidaz…

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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) 3.58 6.64 -16.94 2 7 0 88 375.469 10 ↓

Analogs

8274154
8274154
7287567
7287567

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Popular Name: 2-[(4R)-4-hexyl-4-methyl-2,5-dioxo-imidazolidin-1-yl]-N-[2-(o-tolyl)ethyl]acetamide 2-[(4R)-4-hexyl-4-methyl-2,5-dio…

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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) 4.37 8.34 -14.88 2 6 0 79 373.497 10 ↓

Analogs

8274154
8274154
7287567
7287567

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Popular Name: 2-[(4S)-4-hexyl-4-methyl-2,5-dioxo-imidazolidin-1-yl]-N-[2-(o-tolyl)ethyl]acetamide 2-[(4S)-4-hexyl-4-methyl-2,5-dio…

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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) 4.37 8.41 -15.41 2 6 0 79 373.497 10 ↓

Analogs

14249674
14249674
16636100
16636100
3592727
3592727

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Popular Name: N-[2-(2,4-dichlorophenyl)ethyl]-2-[(4R)-4-isopentyl-4-methyl-2,5-dioxo-imidazolidin-1-yl]acetamide N-[2-(2,4-dichlorophenyl)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) 4.23 7.74 -15.6 2 6 0 79 414.333 8 ↓

Analogs

16636100
16636100
14249672
14249672
3592727
3592727

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Popular Name: N-[2-(2,4-dichlorophenyl)ethyl]-2-[(4S)-4-isopentyl-4-methyl-2,5-dioxo-imidazolidin-1-yl]acetamide N-[2-(2,4-dichlorophenyl)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) 4.23 7.76 -15.81 2 6 0 79 414.333 8 ↓

Analogs

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Popular Name: N-[2-(4-chlorophenyl)ethyl]-2-[(4S)-4-isobutyl-2,5-diketo-4-methyl-imidazolidin-1-yl]acetamide N-[2-(4-chlorophenyl)ethyl]-2-[(…

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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 7.08 -15.77 2 6 0 79 365.861 7 ↓

Analogs

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Popular Name: N-[2-(4-chlorophenyl)ethyl]-2-[(4R)-4-isobutyl-2,5-diketo-4-methyl-imidazolidin-1-yl]acetamide N-[2-(4-chlorophenyl)ethyl]-2-[(…

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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 6.53 -15.67 2 6 0 79 365.861 7 ↓

Analogs

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Popular Name: 2-(4,4-dimethyl-2,5-dioxo-imidazolidin-1-yl)-N-[2-methyl-2-(m-tolyl)propyl]acetamide 2-(4,4-dimethyl-2,5-dioxo-imidaz…

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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) 2.79 5.71 -15.2 2 6 0 79 331.416 5 ↓

Analogs

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Popular Name: N-[2-(5-bromo-2-fluoro-phenyl)ethyl]-2-(4,4-dimethyl-2,5-dioxo-imidazolidin-1-yl)acetamide N-[2-(5-bromo-2-fluoro-phenyl)et…

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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 4.64 -15.97 2 6 0 79 386.221 5 ↓

Analogs

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Popular Name: 2-(4,4-diethyl-2,5-dioxo-imidazolidin-1-yl)-N-[2-(2,4-dimethylphenyl)ethyl]acetamide 2-(4,4-diethyl-2,5-dioxo-imidazo…

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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) 3.23 6.94 -15.42 2 6 0 79 345.443 7 ↓

Analogs

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Popular Name: N-[2-(2,4-dimethylphenyl)ethyl]-2-[(4S)-4-ethyl-4-methyl-2,5-dioxo-imidazolidin-1-yl]acetamide N-[2-(2,4-dimethylphenyl)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) 2.72 5.96 -15.54 2 6 0 79 331.416 6 ↓

Analogs

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Popular Name: N-[2-(4-chlorophenyl)ethyl]-2-[(4S)-4-ethyl-4-isopropyl-2,5-dioxo-imidazolidin-1-yl]acetamide N-[2-(4-chlorophenyl)ethyl]-2-[(…

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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) 3.32 6.72 -15.57 2 6 0 79 365.861 7 ↓

Analogs

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Popular Name: N-[2-(4-chlorophenyl)ethyl]-2-[(4R)-4-ethyl-4-isopropyl-2,5-dioxo-imidazolidin-1-yl]acetamide N-[2-(4-chlorophenyl)ethyl]-2-[(…

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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) 3.32 6.87 -15.2 2 6 0 79 365.861 7 ↓

Analogs

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Popular Name: N-[2-(4-chlorophenyl)ethyl]-2-[(4S)-4-hexyl-4-methyl-2,5-dioxo-imidazolidin-1-yl]acetamide N-[2-(4-chlorophenyl)ethyl]-2-[(…

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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) 4.65 8.47 -15.86 2 6 0 79 393.915 10 ↓

Analogs

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Popular Name: N-[2-(2-chlorophenyl)ethyl]-2-(4,4-dimethyl-2,5-dioxo-imidazolidin-1-yl)acetamide N-[2-(2-chlorophenyl)ethyl]-2-(4…

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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) 2.03 4.4 -16.15 2 6 0 79 323.78 5 ↓

Parameters Provided:

ring.id = 48876
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 = 48876 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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