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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: (3R)-3-[1-butyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyltetrahydrofuran-2-one (3R)-3-[1-butyl-5-(trifluorometh…

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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) 3.56 11.13 -15.37 0 4 0 44 358.385 6 ↓

Analogs

540949
540949

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Popular Name: (3S)-3-(1H-benzimidazol-2-ylthio)-5,5-dimethyl-3-propionyl-tetrahydrofuran-2-one (3S)-3-(1H-benzimidazol-2-ylthio…

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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) 1.58 8.34 -10.01 1 5 0 72 318.398 4 ↓

Analogs

540948
540948

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Popular Name: (3R)-3-(1H-benzimidazol-2-ylthio)-5,5-dimethyl-3-propionyl-tetrahydrofuran-2-one (3R)-3-(1H-benzimidazol-2-ylthio…

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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) 1.58 8.28 -9.96 1 5 0 72 318.398 4 ↓

Analogs

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Popular Name: (3S,5R)-3-(1H-benzimidazol-2-ylsulfanyl)-5-methyl-tetrahydrofuran-2-one (3S,5R)-3-(1H-benzimidazol-2-yls…

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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 6.7 -14.8 1 4 0 55 248.307 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S,5S)-3-(1H-benzimidazol-2-ylsulfanyl)-5-methyl-tetrahydrofuran-2-one (3S,5S)-3-(1H-benzimidazol-2-yls…

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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 6.62 -15.22 1 4 0 55 248.307 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R,5R)-3-(1H-benzimidazol-2-ylsulfanyl)-5-methyl-tetrahydrofuran-2-one (3R,5R)-3-(1H-benzimidazol-2-yls…

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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 6.66 -14.72 1 4 0 55 248.307 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R,5S)-3-(1H-benzimidazol-2-ylsulfanyl)-5-methyl-tetrahydrofuran-2-one (3R,5S)-3-(1H-benzimidazol-2-yls…

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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 6.7 -14.79 1 4 0 55 248.307 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S,5R)-5-methyl-3-(1-methylbenzimidazol-2-yl)sulfanyl-tetrahydrofuran-2-one (3S,5R)-5-methyl-3-(1-methylbenz…

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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) 1.36 8.37 -16.22 0 4 0 44 262.334 2 ↓
Lo Low (pH 4.5-6) 1.36 8.77 -27.28 1 4 1 45 263.342 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S,5S)-5-methyl-3-(1-methylbenzimidazol-2-yl)sulfanyl-tetrahydrofuran-2-one (3S,5S)-5-methyl-3-(1-methylbenz…

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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) 1.36 8.3 -16.72 0 4 0 44 262.334 2 ↓
Lo Low (pH 4.5-6) 1.36 8.7 -27.11 1 4 1 45 263.342 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R,5R)-5-methyl-3-(1-methylbenzimidazol-2-yl)sulfanyl-tetrahydrofuran-2-one (3R,5R)-5-methyl-3-(1-methylbenz…

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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) 1.36 8.34 -16.26 0 4 0 44 262.334 2 ↓
Lo Low (pH 4.5-6) 1.36 8.74 -27.36 1 4 1 45 263.342 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R,5S)-5-methyl-3-(1-methylbenzimidazol-2-yl)sulfanyl-tetrahydrofuran-2-one (3R,5S)-5-methyl-3-(1-methylbenz…

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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) 1.36 8.37 -16.31 0 4 0 44 262.334 2 ↓
Lo Low (pH 4.5-6) 1.36 8.77 -27.31 1 4 1 45 263.342 2 ↓

Analogs

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Popular Name: (3R)-3-[(6-amino-1H-benzimidazol-2-yl)sulfanyl]tetrahydrofuran-2-one (3R)-3-[(6-amino-1H-benzimidazol…

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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) 0.23 3.83 -15.53 3 5 0 81 249.295 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-[(6-amino-1H-benzimidazol-2-yl)sulfanyl]tetrahydrofuran-2-one (3S)-3-[(6-amino-1H-benzimidazol…

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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) 0.23 3.83 -15.51 3 5 0 81 249.295 2 ↓

Parameters Provided:

ring.id = 215265
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 = 215265 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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