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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: (2S)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]pyrrolidine-2-carboxamide (2S)-1-[(3-phenyl-1,2,4-oxadiazo…

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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) 1.53 2.94 -44.55 3 6 1 86 273.316 4 ↓
Hi High (pH 8-9.5) 1.29 1.44 -36.04 2 6 0 90 272.308 4 ↓

Analogs

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Popular Name: (3S)-3-methyl-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]pyrrolidine-3-carboxylic (3S)-3-methyl-1-[(3-phenyl-1,2,4…

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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) 1.84 7.21 -50.61 1 6 0 83 287.319 4 ↓
Hi High (pH 8-9.5) 1.84 4.65 -46.24 0 6 -1 82 286.311 4 ↓

Analogs

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Popular Name: (3R)-3-methyl-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]pyrrolidine-3-carboxylic (3R)-3-methyl-1-[(3-phenyl-1,2,4…

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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) 1.84 7.15 -49.97 1 6 0 83 287.319 4 ↓
Hi High (pH 8-9.5) 1.84 4.63 -46.27 0 6 -1 82 286.311 4 ↓

Analogs

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Popular Name: (2R)-1-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carbo (2R)-1-[[3-(4-chlorophenyl)-1,2,…

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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) 2.95 6.31 -46 2 6 1 72 389.785 6 ↓
Mid Mid (pH 6-8) 2.95 4.24 -12.93 1 6 0 71 388.777 6 ↓

Analogs

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Popular Name: (2S)-1-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carbo (2S)-1-[[3-(4-chlorophenyl)-1,2,…

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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) 2.95 6.32 -47.05 2 6 1 72 389.785 6 ↓
Mid Mid (pH 6-8) 2.95 4.38 -14.09 1 6 0 71 388.777 6 ↓

Analogs

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Popular Name: (2R)-1-[[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carbo (2R)-1-[[3-(4-ethoxyphenyl)-1,2,…

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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) 2.70 6.01 -46.16 2 7 1 82 399.393 8 ↓
Mid Mid (pH 6-8) 2.70 3.95 -14.57 1 7 0 80 398.385 8 ↓

Analogs

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Popular Name: (2S)-1-[[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carbo (2S)-1-[[3-(4-ethoxyphenyl)-1,2,…

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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) 2.70 6.02 -46.77 2 7 1 82 399.393 8 ↓
Mid Mid (pH 6-8) 2.70 4.09 -15.45 1 7 0 80 398.385 8 ↓

Analogs

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Popular Name: (2R,4R)-4-hydroxy-1-[[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]methyl]pyrrolidine-2-carboxamide (2R,4R)-4-hydroxy-1-[[3-(m-tolyl…

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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) 1.04 0.31 -46.46 4 7 1 107 303.342 4 ↓
Hi High (pH 8-9.5) 1.04 -1.92 -18.89 3 7 0 105 302.334 4 ↓

Analogs

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Popular Name: (2R,4S)-4-hydroxy-1-[[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]methyl]pyrrolidine-2-carboxamide (2R,4S)-4-hydroxy-1-[[3-(m-tolyl…

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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) 1.04 0.28 -44.32 4 7 1 107 303.342 4 ↓
Hi High (pH 8-9.5) 1.04 -1.77 -16.09 3 7 0 105 302.334 4 ↓

Analogs

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Popular Name: 4-[5-[[(3R)-3-(ethylcarbamoyl)pyrrolidin-1-yl]methyl]-1,2,4-oxadiazol-3-yl]benzoic 4-[5-[[(3R)-3-(ethylcarbamoyl)py…

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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) 1.75 5.63 -78.37 2 8 0 113 344.371 6 ↓

Analogs

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Popular Name: 4-[5-[[(3S)-3-(ethylcarbamoyl)pyrrolidin-1-yl]methyl]-1,2,4-oxadiazol-3-yl]benzoic 4-[5-[[(3S)-3-(ethylcarbamoyl)py…

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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) 1.75 5.71 -79.08 2 8 0 113 344.371 6 ↓

Analogs

52246224
52246224

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Popular Name: 3-(m-tolyl)-5-(pyrrolidin-1-ylmethyl)-1,2,4-oxadiazole 3-(m-tolyl)-5-(pyrrolidin-1-ylme…

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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) 2.68 6.85 -40.04 1 4 1 43 244.318 3 ↓

Parameters Provided:

ring.id = 28782
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 = 28782 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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