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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: [4-(3-chlorophenyl)piperazin-1-yl]-[3-(2-fluorophenyl)-1-methyl-thieno[4,5-d]pyrazol-5-yl]methanone [4-(3-chlorophenyl)piperazin-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) 5.16 10.72 -14.08 0 5 0 41 454.958 3 ↓

Analogs

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Popular Name: [3-(2-fluorophenyl)-1-methyl-thieno[4,5-d]pyrazol-5-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone [3-(2-fluorophenyl)-1-methyl-thi…

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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) 4.47 10.87 -19.66 0 8 0 87 465.51 4 ↓

Analogs

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Popular Name: [3-(2-fluorophenyl)-1-methyl-thieno[4,5-d]pyrazol-5-yl]-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl [3-(2-fluorophenyl)-1-methyl-thi…

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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) 5.38 11.2 -14.82 0 5 0 41 488.51 4 ↓

Analogs

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Popular Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-[3-(2-fluorophenyl)-1-methyl-thieno[4,5-d]pyrazol-5-yl]methan [4-(2,3-dimethylphenyl)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) 5.31 12.41 -13.75 0 5 0 41 448.567 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [4-(2,5-dimethylphenyl)piperazin-1-yl]-[3-(2-fluorophenyl)-1-methyl-thieno[4,5-d]pyrazol-5-yl]methan [4-(2,5-dimethylphenyl)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) 5.33 12.4 -13.64 0 5 0 41 448.567 3 ↓

Analogs

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Popular Name: [3-(4-chlorophenyl)-1-methyl-thieno[4,5-d]pyrazol-5-yl]-[4-(2-fluorophenyl)piperazin-1-yl]methanone [3-(4-chlorophenyl)-1-methyl-thi…

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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) 5.19 10.62 -11.34 0 5 0 41 454.958 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [3-(4-chlorophenyl)-1-methyl-thieno[4,5-d]pyrazol-5-yl]-[4-(3-chlorophenyl)piperazin-1-yl]methanone [3-(4-chlorophenyl)-1-methyl-thi…

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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) 5.72 11.11 -11.24 0 5 0 41 471.413 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [3-(4-chlorophenyl)-1-methyl-thieno[4,5-d]pyrazol-5-yl]-[4-(4-fluorophenyl)piperazin-1-yl]methanone [3-(4-chlorophenyl)-1-methyl-thi…

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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) 5.23 10.7 -11.96 0 5 0 41 454.958 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [3-(4-chlorophenyl)-1-methyl-thieno[4,5-d]pyrazol-5-yl]-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl [3-(4-chlorophenyl)-1-methyl-thi…

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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) 5.94 11.61 -12.45 0 5 0 41 504.965 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-[3-(4-chlorophenyl)-1-methyl-thieno[4,5-d]pyrazol-5-yl] [4-(5-chloro-2-methyl-phenyl)pip…

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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) 6.13 12.3 -11.17 0 5 0 41 485.44 3 ↓

Analogs

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Popular Name: 1-[4-[4-[3-(4-chlorophenyl)-1-methyl-thieno[4,5-d]pyrazole-5-carbonyl]piperazin-1-yl]phenyl]ethanone 1-[4-[4-[3-(4-chlorophenyl)-1-me…

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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) 4.97 11.01 -15.3 0 6 0 58 479.005 4 ↓

Analogs

39267436
39267436

Draw Identity 99% 90% 80% 70%

Popular Name: [3-(4-chlorophenyl)-1-methyl-thieno[4,5-d]pyrazol-5-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methan [3-(4-chlorophenyl)-1-methyl-thi…

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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) 5.87 12.85 -10.43 0 5 0 41 465.022 3 ↓

Analogs

39267436
39267436

Draw Identity 99% 90% 80% 70%

Popular Name: [3-(4-chlorophenyl)-1-methyl-thieno[4,5-d]pyrazol-5-yl]-[4-(2,5-dimethylphenyl)piperazin-1-yl]methan [3-(4-chlorophenyl)-1-methyl-thi…

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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) 5.90 12.81 -10.39 0 5 0 41 465.022 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [3-(4-chlorophenyl)-1-methyl-thieno[4,5-d]pyrazol-5-yl]-[4-(4-chlorophenyl)piperazin-1-yl]methanone [3-(4-chlorophenyl)-1-methyl-thi…

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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) 5.75 11.16 -11.33 0 5 0 41 471.413 3 ↓

Parameters Provided:

ring.id = 68359
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 = 68359 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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