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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: (R)-(7-bromo-1,3-benzodioxol-5-yl)-(1-methylimidazol-2-yl)methanol (R)-(7-bromo-1,3-benzodioxol-5-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) 1.65 3.89 -37.69 2 5 1 58 312.143 2 ↓
Mid Mid (pH 6-8) 1.65 3.3 -10.68 1 5 0 57 311.135 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(7-bromo-1,3-benzodioxol-5-yl)-(1-methylimidazol-2-yl)methanol (S)-(7-bromo-1,3-benzodioxol-5-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) 1.65 3.9 -37.96 2 5 1 58 312.143 2 ↓
Mid Mid (pH 6-8) 1.65 3.28 -10.49 1 5 0 57 311.135 2 ↓

Analogs

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Popular Name: (R)-(7-chloro-1,3-benzodioxol-5-yl)-(1-methylimidazol-2-yl)methanol (R)-(7-chloro-1,3-benzodioxol-5-…

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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) 1.51 3.79 -37.96 2 5 1 58 267.692 2 ↓
Mid Mid (pH 6-8) 1.51 3.19 -10.72 1 5 0 57 266.684 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(7-chloro-1,3-benzodioxol-5-yl)-(1-methylimidazol-2-yl)methanol (S)-(7-chloro-1,3-benzodioxol-5-…

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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) 1.51 3.79 -38.18 2 5 1 58 267.692 2 ↓
Mid Mid (pH 6-8) 1.51 3.18 -10.6 1 5 0 57 266.684 2 ↓

Analogs

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Popular Name: (R)-(7-bromo-1,3-benzodioxol-5-yl)-(1-propylimidazol-2-yl)methanol (R)-(7-bromo-1,3-benzodioxol-5-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) 2.52 5.5 -36.83 2 5 1 58 340.197 4 ↓
Mid Mid (pH 6-8) 2.52 4.95 -9.62 1 5 0 57 339.189 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(7-bromo-1,3-benzodioxol-5-yl)-(1-propylimidazol-2-yl)methanol (S)-(7-bromo-1,3-benzodioxol-5-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) 2.52 5.28 -36.8 2 5 1 58 340.197 4 ↓
Mid Mid (pH 6-8) 2.52 4.73 -9.22 1 5 0 57 339.189 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (R)-(7-bromo-1,3-benzodioxol-5-yl)-(1-ethylimidazol-2-yl)methanol (R)-(7-bromo-1,3-benzodioxol-5-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) 2.02 4.75 -36.74 2 5 1 58 326.17 3 ↓
Mid Mid (pH 6-8) 2.02 4.2 -10.05 1 5 0 57 325.162 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(7-bromo-1,3-benzodioxol-5-yl)-(1-ethylimidazol-2-yl)methanol (S)-(7-bromo-1,3-benzodioxol-5-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) 2.02 4.52 -36.87 2 5 1 58 326.17 3 ↓
Mid Mid (pH 6-8) 2.02 3.97 -9.75 1 5 0 57 325.162 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (R)-(7-chloro-1,3-benzodioxol-5-yl)-(1-propylimidazol-2-yl)methanol (R)-(7-chloro-1,3-benzodioxol-5-…

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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) 2.39 5.4 -37.08 2 5 1 58 295.746 4 ↓
Mid Mid (pH 6-8) 2.39 4.84 -9.7 1 5 0 57 294.738 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(7-chloro-1,3-benzodioxol-5-yl)-(1-propylimidazol-2-yl)methanol (S)-(7-chloro-1,3-benzodioxol-5-…

Find On: PubMed — Wikipedia — Google

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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) 2.39 5.18 -37.1 2 5 1 58 295.746 4 ↓
Mid Mid (pH 6-8) 2.39 4.62 -9.31 1 5 0 57 294.738 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (R)-(7-chloro-1,3-benzodioxol-5-yl)-(1-ethylimidazol-2-yl)methanol (R)-(7-chloro-1,3-benzodioxol-5-…

Find On: PubMed — Wikipedia — Google

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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) 1.89 4.63 -37 2 5 1 58 281.719 3 ↓
Mid Mid (pH 6-8) 1.89 4.09 -10.14 1 5 0 57 280.711 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(7-chloro-1,3-benzodioxol-5-yl)-(1-ethylimidazol-2-yl)methanol (S)-(7-chloro-1,3-benzodioxol-5-…

Find On: PubMed — Wikipedia — Google

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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) 1.89 4.42 -37.07 2 5 1 58 281.719 3 ↓
Mid Mid (pH 6-8) 1.89 3.86 -9.84 1 5 0 57 280.711 3 ↓

Parameters Provided:

ring.id = 30724
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 = 30724 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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