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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-(4-chloro-3,5-dimethyl-pyrazol-1-yl)phenyl]-(4-methylsulfonylpiperazin-1-yl)methanone [4-(4-chloro-3,5-dimethyl-pyrazo…

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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) 0.94 5.62 -16.77 0 7 0 76 396.9 3 ↓

Analogs

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Popular Name: N-allyl-2-[4-[4-(5-methylpyrazol-1-yl)benzoyl]piperazin-1-yl]acetamide N-allyl-2-[4-[4-(5-methylpyrazol…

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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) 0.99 5.45 -15.39 1 7 0 70 367.453 6 ↓

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) 1.19 7.69 -13.11 0 7 0 68 342.399 4 ↓

Analogs

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Popular Name: 4-[4-(5-amino-4-cyano-pyrazol-1-yl)benzoyl]-N,N-dimethyl-piperazine-1-sulfonamide 4-[4-(5-amino-4-cyano-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) -0.81 3.91 -18.41 2 10 0 129 403.468 4 ↓

Analogs

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Popular Name: [4-(3,5-dimethylpyrazol-1-yl)phenyl]-(4-methylsulfonylpiperazin-1-yl)methanone [4-(3,5-dimethylpyrazol-1-yl)phe…

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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) 0.34 5.12 -17.96 0 7 0 76 362.455 3 ↓

Analogs

39302098
39302098

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Popular Name: 1-[4-[4-(3,5-dimethylpyrazol-1-yl)benzoyl]piperazin-1-yl]-2-methyl-propan-1-one 1-[4-[4-(3,5-dimethylpyrazol-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) 1.41 8.59 -20.5 0 6 0 58 354.454 3 ↓

Analogs

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Popular Name: [4-(2,2-difluoroethyl)piperazin-1-yl]-(3-fluoro-4-pyrazol-1-yl-phenyl)methanone [4-(2,2-difluoroethyl)piperazin-…

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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) 1.39 6.4 -13.93 0 5 0 41 338.333 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [4-(3,5-dimethylpyrazol-1-yl)-3-fluoro-phenyl]-(4-ethylsulfonylpiperazin-1-yl)methanone [4-(3,5-dimethylpyrazol-1-yl)-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) 1.02 6.16 -25.35 0 7 0 76 394.472 4 ↓

Analogs

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Popular Name: 2-[4-[4-(4-methylpyrazol-1-yl)benzoyl]piperazin-1-yl]acetamide 2-[4-[4-(4-methylpyrazol-1-yl)be…

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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) -0.37 2.84 -16.14 2 7 0 84 327.388 4 ↓

Analogs

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Popular Name: [4-(2-hydroxy-2-methyl-propyl)piperazin-1-yl]-[4-(4-methylpyrazol-1-yl)phenyl]methanone [4-(2-hydroxy-2-methyl-propyl)pi…

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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) 1.07 5.6 -10.54 1 6 0 62 342.443 4 ↓
Lo Low (pH 4.5-6) 1.07 7.36 -46.54 2 6 1 63 343.451 4 ↓

Analogs

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Popular Name: (3-fluoro-4-pyrazol-1-yl-phenyl)-[4-(2-hydroxy-2-methyl-propyl)piperazin-1-yl]methanone (3-fluoro-4-pyrazol-1-yl-phenyl)…

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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) 1.00 4.94 -10.27 1 6 0 62 346.406 4 ↓
Lo Low (pH 4.5-6) 1.00 6.71 -48.3 2 6 1 63 347.414 4 ↓

Analogs

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Popular Name: (3-fluoro-4-pyrazol-1-yl-phenyl)-[4-[(2S)-2-hydroxybutyl]piperazin-1-yl]methanone (3-fluoro-4-pyrazol-1-yl-phenyl)…

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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) 1.06 4.17 -10.69 1 6 0 62 346.406 5 ↓
Lo Low (pH 4.5-6) 1.06 6.44 -49.46 2 6 1 63 347.414 5 ↓

Analogs

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Popular Name: (3-fluoro-4-pyrazol-1-yl-phenyl)-[4-[(2R)-2-hydroxybutyl]piperazin-1-yl]methanone (3-fluoro-4-pyrazol-1-yl-phenyl)…

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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) 1.06 4.2 -10.34 1 6 0 62 346.406 5 ↓
Lo Low (pH 4.5-6) 1.06 6.39 -49.41 2 6 1 63 347.414 5 ↓

Parameters Provided:

ring.id = 27085
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 = 27085 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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