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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,4S)-4-tetrahydropyran-4-ylpyrrolidine-3-carboxylic (3R,4S)-4-tetrahydropyran-4-ylpy…

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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) 0.70 3.2 -53.19 2 4 0 66 199.25 2 ↓
Hi High (pH 8-9.5) 0.70 1.74 -41.99 1 4 -1 61 198.242 2 ↓

Analogs

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Popular Name: (3R,4R)-4-tetrahydropyran-4-ylpyrrolidine-3-carboxylic (3R,4R)-4-tetrahydropyran-4-ylpy…

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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) 0.70 3.37 -57.39 2 4 0 66 199.25 2 ↓
Hi High (pH 8-9.5) 0.70 1.92 -45.67 1 4 -1 61 198.242 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S,4S)-4-tetrahydropyran-4-ylpyrrolidine-3-carboxylic (3S,4S)-4-tetrahydropyran-4-ylpy…

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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) 0.70 3.44 -52.33 2 4 0 66 199.25 2 ↓
Hi High (pH 8-9.5) 0.70 1.99 -50.53 1 4 -1 61 198.242 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S,4R)-4-tetrahydropyran-4-ylpyrrolidine-3-carboxylic (3S,4R)-4-tetrahydropyran-4-ylpy…

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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) 0.70 3.2 -53.18 2 4 0 66 199.25 2 ↓
Hi High (pH 8-9.5) 0.70 1.74 -42.77 1 4 -1 61 198.242 2 ↓

Analogs

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Popular Name: (3S)-1-methyl-3-tetrahydropyran-4-yl-pyrrolidin-3-ol (3S)-1-methyl-3-tetrahydropyran-…

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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) 0.66 1.98 -39.79 2 3 1 34 186.275 1 ↓

Analogs

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Popular Name: (3R)-1-methyl-3-tetrahydropyran-4-yl-pyrrolidin-3-ol (3R)-1-methyl-3-tetrahydropyran-…

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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) 0.66 1.8 -38.41 2 3 1 34 186.275 1 ↓

Analogs

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Popular Name: (3R)-3-tetrahydropyran-4-ylpyrrolidin-3-ol (3R)-3-tetrahydropyran-4-ylpyrro…

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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) 0.41 -0.46 -43.49 3 3 1 46 172.248 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-tetrahydropyran-4-ylpyrrolidin-3-ol (3S)-3-tetrahydropyran-4-ylpyrro…

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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) 0.41 -0.14 -44.34 3 3 1 46 172.248 1 ↓

Analogs

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Popular Name: (2R,3S)-2-isobutyl-3-tetrahydropyran-4-yl-pyrrolidine (2R,3S)-2-isobutyl-3-tetrahydrop…

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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) 3.00 5.46 -39.38 2 2 1 26 212.357 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3S)-2-isobutyl-3-tetrahydropyran-4-yl-pyrrolidine (2S,3S)-2-isobutyl-3-tetrahydrop…

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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) 3.00 6.1 -37.86 2 2 1 26 212.357 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R,3R)-2-isobutyl-3-tetrahydropyran-4-yl-pyrrolidine (2R,3R)-2-isobutyl-3-tetrahydrop…

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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) 3.00 5.61 -39.12 2 2 1 26 212.357 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3R)-2-isobutyl-3-tetrahydropyran-4-yl-pyrrolidine (2S,3R)-2-isobutyl-3-tetrahydrop…

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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) 3.00 5.89 -38.26 2 2 1 26 212.357 3 ↓

Parameters Provided:

ring.id = 260770
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 = 260770 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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