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Analogs

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Popular Name: 2-[[(3R)-1-cyclopentyl-5-oxo-pyrrolidine-3-carbonyl]amino]oxyacetic 2-[[(3R)-1-cyclopentyl-5-oxo-pyr…

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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) -0.12 5.48 -54.6 1 7 -1 99 269.277 5 ↓

Analogs

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Popular Name: 2-[[(3S)-1-cyclopentyl-5-oxo-pyrrolidine-3-carbonyl]amino]oxyacetic 2-[[(3S)-1-cyclopentyl-5-oxo-pyr…

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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) -0.12 5.49 -61.17 1 7 -1 99 269.277 5 ↓

Analogs

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Popular Name: (3R)-1-cyclopentyl-N-[2-(2-hydroxyethoxy)ethyl]-5-oxo-pyrrolidine-3-carboxamide (3R)-1-cyclopentyl-N-[2-(2-hydro…

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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) -0.07 0.92 -14.18 2 6 0 79 284.356 7 ↓

Analogs

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Popular Name: (3S)-1-cyclopentyl-N-[2-(2-hydroxyethoxy)ethyl]-5-oxo-pyrrolidine-3-carboxamide (3S)-1-cyclopentyl-N-[2-(2-hydro…

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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) -0.07 0.96 -16.45 2 6 0 79 284.356 7 ↓

Analogs

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Popular Name: (4S)-1-cyclopentyl-4-[[methyl-[(E)-2-methylbut-2-enyl]amino]methyl]pyrrolidin-2-one (4S)-1-cyclopentyl-4-[[methyl-[(…

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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) 3.04 9.56 -46.83 1 3 1 25 265.421 5 ↓

Analogs

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Popular Name: (4R)-1-cyclopentyl-4-[[methyl-[(E)-2-methylbut-2-enyl]amino]methyl]pyrrolidin-2-one (4R)-1-cyclopentyl-4-[[methyl-[(…

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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) 3.04 9.58 -45.7 1 3 1 25 265.421 5 ↓

Analogs

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Popular Name: (4R)-1-cyclopentyl-4-hydroxy-pyrrolidin-2-one (4R)-1-cyclopentyl-4-hydroxy-pyr…

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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) 0.55 1.66 -8.18 1 3 0 41 169.224 1 ↓

Analogs

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Popular Name: (4S)-1-cyclopentyl-4-hydroxy-pyrrolidin-2-one (4S)-1-cyclopentyl-4-hydroxy-pyr…

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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) 0.55 1.62 -10.12 1 3 0 41 169.224 1 ↓

Analogs

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

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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) 0.02 2.17 -9.49 1 4 0 50 199.25 2 ↓

Analogs

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

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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) 0.02 0.65 -7.38 1 4 0 50 199.25 2 ↓

Analogs

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

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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) 0.02 0.7 -10.43 1 4 0 50 199.25 2 ↓

Analogs

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

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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) 0.02 1.18 -8.96 1 4 0 50 199.25 2 ↓

Analogs

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

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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) 0.79 2.79 -7.4 1 3 0 41 183.251 1 ↓

Analogs

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

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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) 0.79 2.24 -8.09 1 3 0 41 183.251 1 ↓

Analogs

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

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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) 0.79 2.28 -8.01 1 3 0 41 183.251 1 ↓

Analogs

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

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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) 0.79 2.58 -6.88 1 3 0 41 183.251 1 ↓

Analogs

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Popular Name: 5-[[(3R)-1-cyclopentyl-5-oxo-pyrrolidine-3-carbonyl]amino]pentanoic 5-[[(3R)-1-cyclopentyl-5-oxo-pyr…

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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) 0.96 6.24 -52.76 1 6 -1 90 295.359 7 ↓
Lo Low (pH 4.5-6) 0.96 4.26 -16.94 2 6 0 87 296.367 7 ↓

Analogs

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Popular Name: 5-[[(3S)-1-cyclopentyl-5-oxo-pyrrolidine-3-carbonyl]amino]pentanoic 5-[[(3S)-1-cyclopentyl-5-oxo-pyr…

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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) 0.96 6.26 -57.14 1 6 -1 90 295.359 7 ↓
Lo Low (pH 4.5-6) 0.96 4.29 -20.14 2 6 0 87 296.367 7 ↓

Analogs

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Popular Name: (4S)-4-[[(3R)-1-cyclopentyl-5-oxo-pyrrolidine-3-carbonyl]amino]pentanoic (4S)-4-[[(3R)-1-cyclopentyl-5-ox…

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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) 0.79 6.46 -49.24 1 6 -1 90 295.359 6 ↓
Lo Low (pH 4.5-6) 0.79 4.48 -14.26 2 6 0 87 296.367 6 ↓

Analogs

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Popular Name: (4R)-4-[[(3R)-1-cyclopentyl-5-oxo-pyrrolidine-3-carbonyl]amino]pentanoic (4R)-4-[[(3R)-1-cyclopentyl-5-ox…

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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) 0.79 6.47 -47.77 1 6 -1 90 295.359 6 ↓
Lo Low (pH 4.5-6) 0.79 4.49 -14.67 2 6 0 87 296.367 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-4-[[(3S)-1-cyclopentyl-5-oxo-pyrrolidine-3-carbonyl]amino]pentanoic (4S)-4-[[(3S)-1-cyclopentyl-5-ox…

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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) 0.79 6.54 -50.32 1 6 -1 90 295.359 6 ↓
Lo Low (pH 4.5-6) 0.79 4.56 -17.3 2 6 0 87 296.367 6 ↓

Analogs

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Popular Name: (4R)-4-[[(3S)-1-cyclopentyl-5-oxo-pyrrolidine-3-carbonyl]amino]pentanoic (4R)-4-[[(3S)-1-cyclopentyl-5-ox…

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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) 0.79 6.54 -54.72 1 6 -1 90 295.359 6 ↓
Lo Low (pH 4.5-6) 0.79 4.56 -16.06 2 6 0 87 296.367 6 ↓

Analogs

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Popular Name: 1-[[(3R)-1-cyclopentyl-5-oxo-pyrrolidine-3-carbonyl]amino]-3-methyl-urea 1-[[(3R)-1-cyclopentyl-5-oxo-pyr…

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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) 0.08 1.54 -17.87 3 7 0 91 268.317 3 ↓

Analogs

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Popular Name: 1-[[(3S)-1-cyclopentyl-5-oxo-pyrrolidine-3-carbonyl]amino]-3-methyl-urea 1-[[(3S)-1-cyclopentyl-5-oxo-pyr…

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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) 0.08 1.57 -21.24 3 7 0 91 268.317 3 ↓

Analogs

49475084
49475084
20285427
20285427

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Popular Name: 1-(2-oxopyrrolidin-1-yl)cyclopentanecarboxylic 1-(2-oxopyrrolidin-1-yl)cyclopen…

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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) -1.20 5.65 -60.78 0 4 -1 60 196.226 2 ↓

Analogs

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Popular Name: (3R)-1-cyclopentyl-N-isopropylsulfonyl-5-oxo-pyrrolidine-3-carboxamide (3R)-1-cyclopentyl-N-isopropylsu…

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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) 0.97 2.21 -49.2 0 6 -1 90 301.388 4 ↓

Analogs

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Popular Name: (3S)-1-cyclopentyl-N-isopropylsulfonyl-5-oxo-pyrrolidine-3-carboxamide (3S)-1-cyclopentyl-N-isopropylsu…

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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) 0.97 2.16 -52.75 0 6 -1 90 301.388 4 ↓

Analogs

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Popular Name: 2-[[(3R)-1-cyclopentyl-5-oxo-pyrrolidine-3-carbonyl]-propyl-amino]acetic 2-[[(3R)-1-cyclopentyl-5-oxo-pyr…

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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) 0.13 7.99 -43.43 0 6 -1 81 295.359 6 ↓

Analogs

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Popular Name: 2-[[(3S)-1-cyclopentyl-5-oxo-pyrrolidine-3-carbonyl]-propyl-amino]acetic 2-[[(3S)-1-cyclopentyl-5-oxo-pyr…

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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) 0.13 8.03 -49.95 0 6 -1 81 295.359 6 ↓

Parameters Provided:

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filter.purchasability = annotated
page.format = targets
page.num = 1

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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 = 52423 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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