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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-(cyclopentylmethyl)-5-oxo-pyrrolidine-2-carboxylic (2S)-1-(cyclopentylmethyl)-5-oxo…

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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) -0.37 6.87 -44.23 0 4 -1 60 210.253 3 ↓

Analogs

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Popular Name: (2R)-1-(cyclopentylmethyl)-5-oxo-pyrrolidine-2-carboxylic (2R)-1-(cyclopentylmethyl)-5-oxo…

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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) -0.37 6.39 -44.68 0 4 -1 60 210.253 3 ↓

Analogs

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Popular Name: (3R)-1-[(1S)-1-cyclopentylethyl]-5-oxo-pyrrolidine-3-carboxylic (3R)-1-[(1S)-1-cyclopentylethyl]…

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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) 1.52 7.29 -42.15 0 4 -1 60 224.28 3 ↓
Lo Low (pH 4.5-6) 1.52 5.28 -9.48 1 4 0 58 225.288 3 ↓

Analogs

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Popular Name: (3R)-1-[(1R)-1-cyclopentylethyl]-5-oxo-pyrrolidine-3-carboxylic (3R)-1-[(1R)-1-cyclopentylethyl]…

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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) 1.52 7.01 -42.7 0 4 -1 60 224.28 3 ↓
Lo Low (pH 4.5-6) 1.52 5.01 -9.55 1 4 0 58 225.288 3 ↓

Analogs

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Popular Name: (3S)-1-[(1S)-1-cyclopentylethyl]-5-oxo-pyrrolidine-3-carboxylic (3S)-1-[(1S)-1-cyclopentylethyl]…

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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) 1.52 7.23 -48.41 0 4 -1 60 224.28 3 ↓
Lo Low (pH 4.5-6) 1.52 5.14 -11.67 1 4 0 58 225.288 3 ↓

Analogs

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Popular Name: (3S)-1-[(1R)-1-cyclopentylethyl]-5-oxo-pyrrolidine-3-carboxylic (3S)-1-[(1R)-1-cyclopentylethyl]…

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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) 1.52 6.95 -46.35 0 4 -1 60 224.28 3 ↓
Lo Low (pH 4.5-6) 1.52 5.02 -11.91 1 4 0 58 225.288 3 ↓

Analogs

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Popular Name: (3S)-3-amino-1-[(1S)-1-cyclopentylethyl]pyrrolidin-2-one (3S)-3-amino-1-[(1S)-1-cyclopent…

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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) 0.77 3.98 -46.91 3 3 1 48 197.302 2 ↓
Hi High (pH 8-9.5) 0.77 3.68 -7 2 3 0 46 196.294 2 ↓

Analogs

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Popular Name: (3S)-3-amino-1-[(1R)-1-cyclopentylethyl]pyrrolidin-2-one (3S)-3-amino-1-[(1R)-1-cyclopent…

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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) 0.77 3.83 -47.38 3 3 1 48 197.302 2 ↓
Hi High (pH 8-9.5) 0.77 3.52 -6.9 2 3 0 46 196.294 2 ↓

Analogs

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Popular Name: (3R)-3-amino-1-[(1S)-1-cyclopentylethyl]pyrrolidin-2-one (3R)-3-amino-1-[(1S)-1-cyclopent…

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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) 0.77 3.98 -44.91 3 3 1 48 197.302 2 ↓
Hi High (pH 8-9.5) 0.77 3.69 -8.33 2 3 0 46 196.294 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-amino-1-[(1R)-1-cyclopentylethyl]pyrrolidin-2-one (3R)-3-amino-1-[(1R)-1-cyclopent…

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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) 0.77 3.83 -44.54 3 3 1 48 197.302 2 ↓
Hi High (pH 8-9.5) 0.77 3.54 -8.15 2 3 0 46 196.294 2 ↓

Analogs

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Popular Name: (4R)-4-amino-1-[(1S)-1-cyclopentylethyl]pyrrolidin-2-one (4R)-4-amino-1-[(1S)-1-cyclopent…

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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) 0.77 4.01 -58.12 3 3 1 48 197.302 2 ↓
Hi High (pH 8-9.5) 0.77 3.73 -6.97 2 3 0 46 196.294 2 ↓

Analogs

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Popular Name: (4R)-4-amino-1-[(1R)-1-cyclopentylethyl]pyrrolidin-2-one (4R)-4-amino-1-[(1R)-1-cyclopent…

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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) 0.77 3.74 -57.89 3 3 1 48 197.302 2 ↓
Hi High (pH 8-9.5) 0.77 3.45 -6.95 2 3 0 46 196.294 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-4-amino-1-[(1S)-1-cyclopentylethyl]pyrrolidin-2-one (4S)-4-amino-1-[(1S)-1-cyclopent…

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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) 0.77 4.01 -55.85 3 3 1 48 197.302 2 ↓
Hi High (pH 8-9.5) 0.77 3.74 -8.72 2 3 0 46 196.294 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-4-amino-1-[(1R)-1-cyclopentylethyl]pyrrolidin-2-one (4S)-4-amino-1-[(1R)-1-cyclopent…

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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) 0.77 3.75 -54.65 3 3 1 48 197.302 2 ↓
Hi High (pH 8-9.5) 0.77 3.46 -8.64 2 3 0 46 196.294 2 ↓

Analogs

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Popular Name: (3S)-3-bromo-1-[(1S)-1-cyclopentylethyl]pyrrolidin-2-one (3S)-3-bromo-1-[(1S)-1-cyclopent…

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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) 2.63 7.35 -7.67 0 2 0 20 260.175 2 ↓

Analogs

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Popular Name: (3S)-3-bromo-1-[(1R)-1-cyclopentylethyl]pyrrolidin-2-one (3S)-3-bromo-1-[(1R)-1-cyclopent…

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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) 2.63 7.07 -7.75 0 2 0 20 260.175 2 ↓

Analogs

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Popular Name: (3R)-3-bromo-1-[(1S)-1-cyclopentylethyl]pyrrolidin-2-one (3R)-3-bromo-1-[(1S)-1-cyclopent…

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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) 2.63 7.06 -8.46 0 2 0 20 260.175 2 ↓

Analogs

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Popular Name: (3R)-3-bromo-1-[(1R)-1-cyclopentylethyl]pyrrolidin-2-one (3R)-3-bromo-1-[(1R)-1-cyclopent…

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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) 2.63 7.07 -8.36 0 2 0 20 260.175 2 ↓

Analogs

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Popular Name: (4R)-1-(cyclopentylmethyl)-4-hydroxy-pyrrolidin-2-one (4R)-1-(cyclopentylmethyl)-4-hyd…

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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) 0.93 2.42 -7.71 1 3 0 41 183.251 2 ↓

Analogs

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Popular Name: (4S)-1-(cyclopentylmethyl)-4-hydroxy-pyrrolidin-2-one (4S)-1-(cyclopentylmethyl)-4-hyd…

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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) 0.93 2.47 -8.52 1 3 0 41 183.251 2 ↓

Analogs

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Popular Name: (4R)-4-hydroxy-1-[(1-methylcyclopentyl)methyl]pyrrolidin-2-one (4R)-4-hydroxy-1-[(1-methylcyclo…

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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) 1.18 2.92 -7.55 1 3 0 41 197.278 2 ↓

Analogs

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Popular Name: (4S)-4-hydroxy-1-[(1-methylcyclopentyl)methyl]pyrrolidin-2-one (4S)-4-hydroxy-1-[(1-methylcyclo…

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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) 1.18 2.91 -7.76 1 3 0 41 197.278 2 ↓

Analogs

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Popular Name: (4R)-1-[(1S)-1-cyclopentylethyl]-4-hydroxy-pyrrolidin-2-one (4R)-1-[(1S)-1-cyclopentylethyl]…

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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) 1.26 3.36 -8.08 1 3 0 41 197.278 2 ↓

Analogs

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Popular Name: (4R)-1-[(1R)-1-cyclopentylethyl]-4-hydroxy-pyrrolidin-2-one (4R)-1-[(1R)-1-cyclopentylethyl]…

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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) 1.26 3.08 -8.13 1 3 0 41 197.278 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-1-[(1S)-1-cyclopentylethyl]-4-hydroxy-pyrrolidin-2-one (4S)-1-[(1S)-1-cyclopentylethyl]…

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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) 1.26 3.07 -9.83 1 3 0 41 197.278 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-1-[(1R)-1-cyclopentylethyl]-4-hydroxy-pyrrolidin-2-one (4S)-1-[(1R)-1-cyclopentylethyl]…

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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) 1.26 3.08 -9.87 1 3 0 41 197.278 2 ↓

Parameters Provided:

ring.id = 216860
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 = 216860 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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