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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: N-methyl-1-[(2S)-1-[(3R)-tetrahydrofuran-3-yl]pyrrolidin-2-yl]methanamine N-methyl-1-[(2S)-1-[(3R)-tetrahy…

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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) 0.62 1.99 -37.7 2 3 1 29 185.291 3 ↓
Mid Mid (pH 6-8) 0.62 3.6 -104.8 3 3 2 30 186.299 3 ↓

Analogs

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Popular Name: N-methyl-1-[(2R)-1-[(3R)-tetrahydrofuran-3-yl]pyrrolidin-2-yl]methanamine N-methyl-1-[(2R)-1-[(3R)-tetrahy…

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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) 0.62 1.94 -38.55 2 3 1 29 185.291 3 ↓
Mid Mid (pH 6-8) 0.62 3.71 -112.61 3 3 2 30 186.299 3 ↓

Analogs

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Popular Name: N-[[(2S)-1-[(3R)-tetrahydrofuran-3-yl]pyrrolidin-2-yl]methyl]ethanamine N-[[(2S)-1-[(3R)-tetrahydrofuran…

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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) 0.65 2.84 -36.88 2 3 1 29 199.318 4 ↓
Mid Mid (pH 6-8) 0.65 4.46 -105.51 3 3 2 30 200.326 4 ↓

Analogs

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Popular Name: N-[[(2R)-1-[(3R)-tetrahydrofuran-3-yl]pyrrolidin-2-yl]methyl]ethanamine N-[[(2R)-1-[(3R)-tetrahydrofuran…

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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) 0.65 2.79 -37.65 2 3 1 29 199.318 4 ↓
Mid Mid (pH 6-8) 0.65 4.55 -112.68 3 3 2 30 200.326 4 ↓

Analogs

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Popular Name: N-[[(2S)-1-[(3R)-tetrahydrofuran-3-yl]pyrrolidin-2-yl]methyl]propan-1-amine N-[[(2S)-1-[(3R)-tetrahydrofuran…

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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) 1.15 3.6 -37.76 2 3 1 29 213.345 5 ↓
Mid Mid (pH 6-8) 1.15 5.22 -107.66 3 3 2 30 214.353 5 ↓

Analogs

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Popular Name: N-[[(2R)-1-[(3R)-tetrahydrofuran-3-yl]pyrrolidin-2-yl]methyl]propan-1-amine N-[[(2R)-1-[(3R)-tetrahydrofuran…

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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) 1.15 3.54 -38.55 2 3 1 29 213.345 5 ↓
Mid Mid (pH 6-8) 1.15 5.32 -115.2 3 3 2 30 214.353 5 ↓

Analogs

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Popular Name: N-[[(2S)-1-[(3R)-tetrahydrofuran-3-yl]pyrrolidin-2-yl]methyl]propan-2-amine N-[[(2S)-1-[(3R)-tetrahydrofuran…

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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) 1.29 2.18 -38.64 2 3 1 29 213.345 4 ↓
Mid Mid (pH 6-8) 1.29 4.59 -108.05 3 3 2 30 214.353 4 ↓

Analogs

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Popular Name: N-[[(2R)-1-[(3R)-tetrahydrofuran-3-yl]pyrrolidin-2-yl]methyl]propan-2-amine N-[[(2R)-1-[(3R)-tetrahydrofuran…

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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) 1.29 3.31 -36.14 2 3 1 29 213.345 4 ↓
Mid Mid (pH 6-8) 1.29 5.06 -111.73 3 3 2 30 214.353 4 ↓

Analogs

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Popular Name: 2-methyl-N-[[(2S)-1-[(3R)-tetrahydrofuran-3-yl]pyrrolidin-2-yl]methyl]propan-2-amine 2-methyl-N-[[(2S)-1-[(3R)-tetrah…

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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) 1.81 3.83 -34.25 2 3 1 29 227.372 4 ↓
Mid Mid (pH 6-8) 1.81 5.42 -103.61 3 3 2 30 228.38 4 ↓

Analogs

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Popular Name: 2-methyl-N-[[(2R)-1-[(3R)-tetrahydrofuran-3-yl]pyrrolidin-2-yl]methyl]propan-2-amine 2-methyl-N-[[(2R)-1-[(3R)-tetrah…

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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) 1.81 3.73 -34.96 2 3 1 29 227.372 4 ↓
Mid Mid (pH 6-8) 1.81 5.49 -110.61 3 3 2 30 228.38 4 ↓

Analogs

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Popular Name: 2-methyl-N-[[(2S)-1-[(3R)-tetrahydrofuran-3-yl]pyrrolidin-2-yl]methyl]propan-1-amine 2-methyl-N-[[(2S)-1-[(3R)-tetrah…

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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) 1.39 3.12 -40.95 2 3 1 29 227.372 5 ↓
Mid Mid (pH 6-8) 1.39 5.55 -112.28 3 3 2 30 228.38 5 ↓

Analogs

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Popular Name: 2-methyl-N-[[(2R)-1-[(3R)-tetrahydrofuran-3-yl]pyrrolidin-2-yl]methyl]propan-1-amine 2-methyl-N-[[(2R)-1-[(3R)-tetrah…

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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) 1.39 3.42 -40.71 2 3 1 29 227.372 5 ↓
Mid Mid (pH 6-8) 1.39 5.67 -109.81 3 3 2 30 228.38 5 ↓

Analogs

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Popular Name: 2-methoxy-N-[[(2S)-1-[(3R)-tetrahydrofuran-3-yl]pyrrolidin-2-yl]methyl]ethanamine 2-methoxy-N-[[(2S)-1-[(3R)-tetra…

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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) 0.26 1.98 -36.34 2 4 1 38 229.344 6 ↓
Hi High (pH 8-9.5) 0.26 0.35 -2.82 1 4 0 34 228.336 6 ↓
Mid Mid (pH 6-8) 0.26 3.6 -105.95 3 4 2 40 230.352 6 ↓

Analogs

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Popular Name: 2-methoxy-N-[[(2R)-1-[(3R)-tetrahydrofuran-3-yl]pyrrolidin-2-yl]methyl]ethanamine 2-methoxy-N-[[(2R)-1-[(3R)-tetra…

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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) 0.26 1.92 -38.1 2 4 1 38 229.344 6 ↓
Hi High (pH 8-9.5) 0.26 0.6 -2.8 1 4 0 34 228.336 6 ↓
Mid Mid (pH 6-8) 0.26 2.36 -29.21 2 4 1 35 229.344 6 ↓

Analogs

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Popular Name: (2R)-2-(chloromethyl)-1-[(3R)-tetrahydrofuran-3-yl]pyrrolidine (2R)-2-(chloromethyl)-1-[(3R)-te…

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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) 1.44 4.72 -31.73 1 2 1 14 190.694 2 ↓
Mid Mid (pH 6-8) 1.44 2.41 -2.81 0 2 0 12 189.686 2 ↓

Analogs

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Popular Name: (2S)-2-(chloromethyl)-1-[(3R)-tetrahydrofuran-3-yl]pyrrolidine (2S)-2-(chloromethyl)-1-[(3R)-te…

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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) 1.44 4.72 -31.44 1 2 1 14 190.694 2 ↓
Mid Mid (pH 6-8) 1.44 2.64 -2.64 0 2 0 12 189.686 2 ↓

Analogs

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Popular Name: (3R)-3-chloro-1-[(3R)-tetrahydrofuran-3-yl]pyrrolidine (3R)-3-chloro-1-[(3R)-tetrahydro…

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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) 1.17 2.1 -3.85 0 2 0 12 175.659 1 ↓
Mid Mid (pH 6-8) 1.17 4.52 -36.76 1 2 1 14 176.667 1 ↓

Analogs

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Popular Name: (3S)-3-chloro-1-[(3R)-tetrahydrofuran-3-yl]pyrrolidine (3S)-3-chloro-1-[(3R)-tetrahydro…

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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) 1.17 2.1 -2.9 0 2 0 12 175.659 1 ↓
Mid Mid (pH 6-8) 1.17 4.52 -36.01 1 2 1 14 176.667 1 ↓

Analogs

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Popular Name: (3R)-3-(chloromethyl)-1-[(3R)-tetrahydrofuran-3-yl]pyrrolidine (3R)-3-(chloromethyl)-1-[(3R)-te…

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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) 1.55 5.21 -37.27 1 2 1 14 190.694 2 ↓
Hi High (pH 8-9.5) 1.55 2.8 -3.11 0 2 0 12 189.686 2 ↓

Analogs

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Popular Name: (3S)-3-(chloromethyl)-1-[(3R)-tetrahydrofuran-3-yl]pyrrolidine (3S)-3-(chloromethyl)-1-[(3R)-te…

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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) 1.55 5.19 -37.25 1 2 1 14 190.694 2 ↓
Hi High (pH 8-9.5) 1.55 2.78 -3.37 0 2 0 12 189.686 2 ↓

Analogs

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Popular Name: (2R)-2-(3-chloropropyl)-1-[(3R)-tetrahydrofuran-3-yl]pyrrolidine (2R)-2-(3-chloropropyl)-1-[(3R)-…

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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) 1.98 6.23 -33.94 1 2 1 14 218.748 4 ↓
Hi High (pH 8-9.5) 1.98 3.87 -3.01 0 2 0 12 217.74 4 ↓

Analogs

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Popular Name: (2S)-2-(3-chloropropyl)-1-[(3R)-tetrahydrofuran-3-yl]pyrrolidine (2S)-2-(3-chloropropyl)-1-[(3R)-…

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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) 1.98 6.25 -34.11 1 2 1 14 218.748 4 ↓
Hi High (pH 8-9.5) 1.98 4.15 -2.79 0 2 0 12 217.74 4 ↓

Analogs

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Popular Name: N-Methyl-N-(4-pyrrolidin-1-yltetrahydrofuran-3-yl)amine N-Methyl-N-(4-pyrrolidin-1-yltet…

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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) 0.35 1.71 -34.07 2 3 1 29 171.264 2 ↓
Mid Mid (pH 6-8) 0.35 0.34 -2.14 1 3 0 24 170.256 2 ↓
Mid Mid (pH 6-8) 0.35 3.66 -109.6 3 3 2 30 172.272 2 ↓

Analogs

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Popular Name: N-Methyl-N-(4-pyrrolidin-1-yltetrahydrofuran-3-yl)amine N-Methyl-N-(4-pyrrolidin-1-yltet…

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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) 0.35 0.64 -37.2 2 3 1 29 171.264 2 ↓
Mid Mid (pH 6-8) 0.35 -0.58 -1.73 1 3 0 24 170.256 2 ↓
Mid Mid (pH 6-8) 0.35 2.92 -106.34 3 3 2 30 172.272 2 ↓

Analogs

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Popular Name: N-Methyl-N-(4-pyrrolidin-1-yltetrahydrofuran-3-yl)amine N-Methyl-N-(4-pyrrolidin-1-yltet…

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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) 0.35 0.55 -40.59 2 3 1 29 171.264 2 ↓
Mid Mid (pH 6-8) 0.35 -0.75 -2.53 1 3 0 24 170.256 2 ↓
Mid Mid (pH 6-8) 0.35 2.97 -107.56 3 3 2 30 172.272 2 ↓

Analogs

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Popular Name: N-Methyl-N-(4-pyrrolidin-1-yltetrahydrofuran-3-yl)amine N-Methyl-N-(4-pyrrolidin-1-yltet…

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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) 0.35 1.75 -34.24 2 3 1 29 171.264 2 ↓
Mid Mid (pH 6-8) 0.35 1.29 -1.53 1 3 0 24 170.256 2 ↓
Mid Mid (pH 6-8) 0.35 3.63 -109.8 3 3 2 30 172.272 2 ↓

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ring.id = 479535
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 = 479535 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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