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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: (2-methylsulfanyl-3-phenyl-imidazol-4-yl)-(4-methylsulfonylpiperazin-1-yl)methanone (2-methylsulfanyl-3-phenyl-imida…

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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) 1.13 5.62 -16.79 0 7 0 76 380.495 4 ↓

Analogs

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Popular Name: [3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]-(4-methylsulfonylpiperazin-1-yl)methanone [3-(4-fluorophenyl)-2-methylsulf…

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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) 1.29 5.69 -15.49 0 7 0 76 398.485 4 ↓

Analogs

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Popular Name: N-allyl-2-[4-(3-phenylimidazole-4-carbonyl)piperazin-1-yl]acetamide N-allyl-2-[4-(3-phenylimidazole-…

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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) 1.09 6.29 -15.15 1 7 0 70 353.426 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) 2.37 8.99 -12.1 0 7 0 68 392.456 5 ↓

Analogs

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Popular Name: N,N-diethyl-4-[3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carbonyl]piperazine-1-sulfonamide N,N-diethyl-4-[3-(4-fluorophenyl…

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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) 2.05 8.04 -13.78 0 8 0 79 455.581 7 ↓

Analogs

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Popular Name: (4-ethylpiperazin-1-yl)-(2-methylsulfanyl-3-phenyl-imidazol-4-yl)methanone (4-ethylpiperazin-1-yl)-(2-methy…

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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) 2.13 7.4 -10.19 0 5 0 41 330.457 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]-(4-methylpiperazin-1-yl)methanone [3-(4-fluorophenyl)-2-methylsulf…

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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) 1.92 6.67 -8.75 0 5 0 41 334.42 3 ↓
Mid Mid (pH 6-8) 1.92 9.02 -46.38 1 5 1 43 335.428 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]-(4-isobutylpiperazin-1-yl)methanone [3-(4-fluorophenyl)-2-methylsulf…

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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) 3.04 9.18 -8.28 0 5 0 41 376.501 5 ↓
Mid Mid (pH 6-8) 3.04 11.1 -45.28 1 5 1 43 377.509 5 ↓

Analogs

55669183
55669183

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Popular Name: [4-(2-hydroxy-2-methyl-propyl)piperazin-1-yl]-(3-phenylimidazol-4-yl)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) 1.01 6.37 -10.02 1 6 0 62 328.416 4 ↓
Lo Low (pH 4.5-6) 1.01 7.96 -43.84 2 6 1 63 329.424 4 ↓

Parameters Provided:

ring.id = 27091
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 = 27091 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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