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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: (4R)-1-[(2-chloro-4-pyridyl)methyl]-4-methyl-pyrrolidin-2-one (4R)-1-[(2-chloro-4-pyridyl)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) 1.67 5.52 -8.74 0 3 0 33 224.691 2 ↓

Analogs

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Popular Name: (4S)-1-[(2-chloro-4-pyridyl)methyl]-4-methyl-pyrrolidin-2-one (4S)-1-[(2-chloro-4-pyridyl)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) 1.67 5.52 -8.76 0 3 0 33 224.691 2 ↓

Analogs

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Popular Name: (4R)-4-methyl-1-[[2-(propylamino)-4-pyridyl]methyl]pyrrolidin-2-one (4R)-4-methyl-1-[[2-(propylamino…

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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) 1.73 6.78 -32.69 2 4 1 46 248.35 5 ↓
Mid Mid (pH 6-8) 1.73 6.3 -9.75 1 4 0 45 247.342 5 ↓

Analogs

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Popular Name: (4S)-4-methyl-1-[[2-(propylamino)-4-pyridyl]methyl]pyrrolidin-2-one (4S)-4-methyl-1-[[2-(propylamino…

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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) 1.73 6.79 -32.51 2 4 1 46 248.35 5 ↓
Mid Mid (pH 6-8) 1.73 6.31 -9.82 1 4 0 45 247.342 5 ↓

Analogs

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Popular Name: (4R)-1-[[2-(ethylamino)-4-pyridyl]methyl]-4-methyl-pyrrolidin-2-one (4R)-1-[[2-(ethylamino)-4-pyridy…

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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) 1.23 6.01 -32.45 2 4 1 46 234.323 4 ↓
Mid Mid (pH 6-8) 1.23 5.54 -10.06 1 4 0 45 233.315 4 ↓

Analogs

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Popular Name: (4S)-1-[[2-(ethylamino)-4-pyridyl]methyl]-4-methyl-pyrrolidin-2-one (4S)-1-[[2-(ethylamino)-4-pyridy…

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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) 1.23 6.02 -32.34 2 4 1 46 234.323 4 ↓
Mid Mid (pH 6-8) 1.23 5.55 -10.13 1 4 0 45 233.315 4 ↓

Analogs

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Popular Name: (4R)-4-methyl-1-[[2-(methylamino)-4-pyridyl]methyl]pyrrolidin-2-one (4R)-4-methyl-1-[[2-(methylamino…

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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) 0.85 5.23 -32.86 2 4 1 46 220.296 3 ↓
Mid Mid (pH 6-8) 0.85 4.75 -10.5 1 4 0 45 219.288 3 ↓

Analogs

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Popular Name: (4S)-4-methyl-1-[[2-(methylamino)-4-pyridyl]methyl]pyrrolidin-2-one (4S)-4-methyl-1-[[2-(methylamino…

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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) 0.85 5.23 -32.7 2 4 1 46 220.296 3 ↓
Mid Mid (pH 6-8) 0.85 4.75 -10.58 1 4 0 45 219.288 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-1-[(2-amino-4-pyridyl)methyl]-4-methyl-pyrrolidin-2-one (4R)-1-[(2-amino-4-pyridyl)methy…

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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) 0.48 4.32 -34.46 3 4 1 60 206.269 2 ↓
Mid Mid (pH 6-8) 0.48 3.85 -10.39 2 4 0 59 205.261 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-1-[(2-amino-4-pyridyl)methyl]-4-methyl-pyrrolidin-2-one (4S)-1-[(2-amino-4-pyridyl)methy…

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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) 0.48 4.32 -34.28 3 4 1 60 206.269 2 ↓
Mid Mid (pH 6-8) 0.48 3.85 -10.45 2 4 0 59 205.261 2 ↓

Analogs

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Popular Name: (4R)-1-[(2-hydrazino-4-pyridyl)methyl]-4-methyl-pyrrolidin-2-one (4R)-1-[(2-hydrazino-4-pyridyl)m…

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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) 0.24 3.75 -11.48 3 5 0 71 220.276 3 ↓
Mid Mid (pH 6-8) 0.24 4.23 -33.05 4 5 1 72 221.284 3 ↓

Analogs

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Popular Name: (4S)-1-[(2-hydrazino-4-pyridyl)methyl]-4-methyl-pyrrolidin-2-one (4S)-1-[(2-hydrazino-4-pyridyl)m…

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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) 0.24 3.75 -11.55 3 5 0 71 220.276 3 ↓
Mid Mid (pH 6-8) 0.24 4.23 -32.83 4 5 1 72 221.284 3 ↓

Analogs

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Popular Name: (4R)-4-hydroxy-1-(4-pyridylmethyl)pyrrolidin-2-one (4R)-4-hydroxy-1-(4-pyridylmethy…

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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) -0.74 1.09 -10.47 1 4 0 53 192.218 2 ↓
Lo Low (pH 4.5-6) -0.74 1.55 -38.87 2 4 1 55 193.226 2 ↓

Analogs

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Popular Name: (4S)-4-hydroxy-1-(4-pyridylmethyl)pyrrolidin-2-one (4S)-4-hydroxy-1-(4-pyridylmethy…

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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) -0.74 1.1 -11.17 1 4 0 53 192.218 2 ↓
Lo Low (pH 4.5-6) -0.74 1.56 -37.28 2 4 1 55 193.226 2 ↓

Analogs

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

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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) -0.18 1.34 -10.69 1 4 0 53 206.245 2 ↓
Lo Low (pH 4.5-6) -0.18 1.8 -39.25 2 4 1 55 207.253 2 ↓

Analogs

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

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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) -0.18 1.62 -10.79 1 4 0 53 206.245 2 ↓
Lo Low (pH 4.5-6) -0.18 2.08 -40.26 2 4 1 55 207.253 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

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

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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) -0.18 1.34 -12.24 1 4 0 53 206.245 2 ↓
Lo Low (pH 4.5-6) -0.18 1.8 -42.79 2 4 1 55 207.253 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

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

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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) -0.18 1.62 -12.76 1 4 0 53 206.245 2 ↓
Lo Low (pH 4.5-6) -0.18 2.07 -37.89 2 4 1 55 207.253 2 ↓

Analogs

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Popular Name: (4R)-4-hydroxy-1-[(2-methoxy-4-pyridyl)methyl]pyrrolidin-2-one (4R)-4-hydroxy-1-[(2-methoxy-4-p…

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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) -0.34 -0.43 -9.79 1 5 0 63 222.244 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-4-hydroxy-1-[(2-methoxy-4-pyridyl)methyl]pyrrolidin-2-one (4S)-4-hydroxy-1-[(2-methoxy-4-p…

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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) -0.34 -0.42 -10.67 1 5 0 63 222.244 3 ↓

Parameters Provided:

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

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