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ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 6-[[(4S)-4-(3,4-dichlorophenyl)-4-methyl-2,5-dioxo-imidazolidin-1-yl]methyl]-1,3-dimethyl-pyrimidine 6-[[(4S)-4-(3,4-dichlorophenyl)-…

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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) 1.65 6.38 -14.66 1 8 0 93 411.245 3 ↓

Analogs

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Popular Name: 6-[[(4R)-4-(3,4-dichlorophenyl)-4-methyl-2,5-dioxo-imidazolidin-1-yl]methyl]-1,3-dimethyl-pyrimidine 6-[[(4R)-4-(3,4-dichlorophenyl)-…

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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) 1.65 6.37 -13.99 1 8 0 93 411.245 3 ↓

Analogs

10498234
10498234

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Popular Name: 6-[[4-(4-chlorophenyl)-4-methyl-2,5-dioxo-imidazolidin-1-yl]methyl]-1,3-dimethyl-pyrimidine-2,4-dion 6-[[4-(4-chlorophenyl)-4-methyl-…

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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) 1.04 -0.96 -13.4 1 8 0 93 376.8 3 ↓

Analogs

10498233
10498233

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Popular Name: 6-[[4-(4-chlorophenyl)-4-methyl-2,5-dioxo-imidazolidin-1-yl]methyl]-1,3-dimethyl-pyrimidine-2,4-dion 6-[[4-(4-chlorophenyl)-4-methyl-…

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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) 1.04 -1.2 -13.52 1 8 0 93 376.8 3 ↓

Analogs

10499650
10499650
10499653
10499653

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Popular Name: 1,3-dimethyl-6-[(4-methyl-2,5-dioxo-4-phenyl-imidazolidin-1-yl)methyl]pyrimidine-2,4-dione 1,3-dimethyl-6-[(4-methyl-2,5-di…

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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) 0.36 5.41 -13.35 1 8 0 93 342.355 3 ↓

Analogs

10499650
10499650
10499653
10499653

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Popular Name: 1,3-dimethyl-6-[(4-methyl-2,5-dioxo-4-phenyl-imidazolidin-1-yl)methyl]pyrimidine-2,4-dione 1,3-dimethyl-6-[(4-methyl-2,5-di…

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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) 0.36 5.4 -12.88 1 8 0 93 342.355 3 ↓

Analogs

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Popular Name: 6-[[4-(3-bromophenyl)-4-methyl-2,5-dioxo-imidazolidin-1-yl]methyl]-1,3-dimethyl-pyrimidine-2,4-dione 6-[[4-(3-bromophenyl)-4-methyl-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) 1.15 -1.62 -13.56 1 8 0 93 421.251 3 ↓

Analogs

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Popular Name: 6-[[4-(3-bromophenyl)-4-methyl-2,5-dioxo-imidazolidin-1-yl]methyl]-1,3-dimethyl-pyrimidine-2,4-dione 6-[[4-(3-bromophenyl)-4-methyl-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) 1.15 -1.61 -13.86 1 8 0 93 421.251 3 ↓

Analogs

10499653
10499653
10537813
10537813
10537815
10537815
10499527
10499527
10499529
10499529

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Popular Name: 1,3-dimethyl-6-[[4-methyl-2,5-dioxo-4-(p-tolyl)imidazolidin-1-yl]methyl]pyrimidine-2,4-dione 1,3-dimethyl-6-[[4-methyl-2,5-di…

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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) 0.81 -0.73 -12.79 1 8 0 93 356.382 3 ↓

Analogs

10537813
10537813
10537815
10537815
10499650
10499650
10499527
10499527
10499529
10499529

Draw Identity 99% 90% 80% 70%

Popular Name: 1,3-dimethyl-6-[[4-methyl-2,5-dioxo-4-(p-tolyl)imidazolidin-1-yl]methyl]pyrimidine-2,4-dione 1,3-dimethyl-6-[[4-methyl-2,5-di…

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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) 0.81 -0.49 -12.73 1 8 0 93 356.382 3 ↓

Analogs

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Popular Name: 6-[[4-(2,5-difluorophenyl)-4-methyl-2,5-dioxo-imidazolidin-1-yl]methyl]-1,3-dimethyl-pyrimidine-2,4- 6-[[4-(2,5-difluorophenyl)-4-met…

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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) 0.62 0.77 -13.45 1 8 0 93 378.335 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-[[4-(2,5-difluorophenyl)-4-methyl-2,5-dioxo-imidazolidin-1-yl]methyl]-1,3-dimethyl-pyrimidine-2,4- 6-[[4-(2,5-difluorophenyl)-4-met…

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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) 0.62 0.55 -13.41 1 8 0 93 378.335 3 ↓

Analogs

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Popular Name: 6-[[4-ethyl-4-(4-methoxyphenyl)-2,5-dioxo-imidazolidin-1-yl]methyl]-1,3-dimethyl-pyrimidine-2,4-dion 6-[[4-ethyl-4-(4-methoxyphenyl)-…

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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) 0.92 -0.09 -14.95 1 9 0 103 386.408 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-[[4-ethyl-4-(4-methoxyphenyl)-2,5-dioxo-imidazolidin-1-yl]methyl]-1,3-dimethyl-pyrimidine-2,4-dion 6-[[4-ethyl-4-(4-methoxyphenyl)-…

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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) 0.92 -0.4 -14.09 1 9 0 103 386.408 5 ↓

Parameters Provided:

ring.id = 3157
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 = 3157 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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