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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

44653838
44653838
44653841
44653841
44654140
44654140
44654143
44654143

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Popular Name: (5S)-3,3-dimethyl-5-(2-thienyl)morpholine (5S)-3,3-dimethyl-5-(2-thienyl)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) 2.23 -1.6 -30.96 2 2 1 26 198.311 1 ↓

Analogs

44653838
44653838
44653841
44653841
44654140
44654140
44654143
44654143

Draw Identity 99% 90% 80% 70%

Popular Name: (5R)-3,3-dimethyl-5-(2-thienyl)morpholine (5R)-3,3-dimethyl-5-(2-thienyl)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) 2.23 -1.6 -31.01 2 2 1 26 198.311 1 ↓

Analogs

44653838
44653838
44653841
44653841

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Popular Name: (3S)-3-methyl-3-(2-thienyl)morpholine (3S)-3-methyl-3-(2-thienyl)morph…

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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) 1.87 3.41 -36.77 2 2 1 26 184.284 1 ↓

Analogs

44653838
44653838
44653841
44653841

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-methyl-3-(2-thienyl)morpholine (3R)-3-methyl-3-(2-thienyl)morph…

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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) 1.87 3.41 -36.78 2 2 1 26 184.284 1 ↓

Analogs

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Popular Name: [(2R,3R)-3-(5-bromo-2-thienyl)-4-methyl-morpholin-2-yl]methanamine [(2R,3R)-3-(5-bromo-2-thienyl)-4…

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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 1.47 -40.21 3 3 1 40 292.222 2 ↓
Hi High (pH 8-9.5) 1.39 1 -2.66 2 3 0 38 291.214 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,3R)-3-(5-bromo-2-thienyl)-4-methyl-morpholin-2-yl]methanamine [(2S,3R)-3-(5-bromo-2-thienyl)-4…

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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 1.41 -41.6 3 3 1 40 292.222 2 ↓
Hi High (pH 8-9.5) 1.39 1.04 -2.94 2 3 0 38 291.214 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,3S)-4-methyl-3-(3-methyl-2-thienyl)morpholin-2-yl]methanamine [(2S,3S)-4-methyl-3-(3-methyl-2-…

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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) 0.84 1.34 -38.94 3 3 1 40 227.353 2 ↓
Hi High (pH 8-9.5) 0.84 0.87 -3.12 2 3 0 38 226.345 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,3R)-4-methyl-3-(3-methyl-2-thienyl)morpholin-2-yl]methanamine [(2S,3R)-4-methyl-3-(3-methyl-2-…

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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) 0.84 1.17 -39.7 3 3 1 40 227.353 2 ↓
Hi High (pH 8-9.5) 0.84 0.72 -3.75 2 3 0 38 226.345 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,3S)-4-methyl-3-(3-methyl-2-thienyl)morpholin-2-yl]methanamine [(2R,3S)-4-methyl-3-(3-methyl-2-…

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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) 0.84 1.18 -39.79 3 3 1 40 227.353 2 ↓
Hi High (pH 8-9.5) 0.84 0.8 -3.57 2 3 0 38 226.345 2 ↓

Analogs

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Popular Name: [(2R,3R)-4-methyl-3-(3-methyl-2-thienyl)morpholin-2-yl]methanamine [(2R,3R)-4-methyl-3-(3-methyl-2-…

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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) 0.84 1.19 -38.97 3 3 1 40 227.353 2 ↓
Hi High (pH 8-9.5) 0.84 0.81 -3.09 2 3 0 38 226.345 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,3R)-4-methyl-3-(2-thienyl)morpholin-2-yl]methanamine [(2R,3R)-4-methyl-3-(2-thienyl)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) 0.46 0.74 -38.94 3 3 1 40 213.326 2 ↓
Hi High (pH 8-9.5) 0.46 0.27 -3.11 2 3 0 38 212.318 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,3R)-4-methyl-3-(2-thienyl)morpholin-2-yl]methanamine [(2S,3R)-4-methyl-3-(2-thienyl)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) 0.46 0.68 -39.53 3 3 1 40 213.326 2 ↓
Hi High (pH 8-9.5) 0.46 0.31 -3.32 2 3 0 38 212.318 2 ↓

Analogs

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Popular Name: [(2S,3S)-3-(5-ethyl-2-thienyl)-4-methyl-morpholin-2-yl]methanamine [(2S,3S)-3-(5-ethyl-2-thienyl)-4…

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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) 1.25 2.47 -38.78 3 3 1 40 241.38 3 ↓
Hi High (pH 8-9.5) 1.25 2.1 -2.9 2 3 0 38 240.372 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,3R)-3-(5-ethyl-2-thienyl)-4-methyl-morpholin-2-yl]methanamine [(2S,3R)-3-(5-ethyl-2-thienyl)-4…

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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) 1.25 2.29 -39.48 3 3 1 40 241.38 3 ↓
Hi High (pH 8-9.5) 1.25 1.93 -3.36 2 3 0 38 240.372 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,3S)-3-(5-ethyl-2-thienyl)-4-methyl-morpholin-2-yl]methanamine [(2R,3S)-3-(5-ethyl-2-thienyl)-4…

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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) 1.25 2.26 -39.39 3 3 1 40 241.38 3 ↓
Hi High (pH 8-9.5) 1.25 1.81 -3.59 2 3 0 38 240.372 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,3R)-3-(5-ethyl-2-thienyl)-4-methyl-morpholin-2-yl]methanamine [(2R,3R)-3-(5-ethyl-2-thienyl)-4…

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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) 1.25 2.35 -38.88 3 3 1 40 241.38 3 ↓
Hi High (pH 8-9.5) 1.25 1.88 -3.04 2 3 0 38 240.372 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,3S)-4-methyl-3-(5-methyl-2-thienyl)morpholin-2-yl]methanamine [(2S,3S)-4-methyl-3-(5-methyl-2-…

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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) 0.68 1.69 -38.93 3 3 1 40 227.353 2 ↓
Hi High (pH 8-9.5) 0.68 1.31 -3.11 2 3 0 38 226.345 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,3R)-4-methyl-3-(5-methyl-2-thienyl)morpholin-2-yl]methanamine [(2S,3R)-4-methyl-3-(5-methyl-2-…

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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) 0.68 1.51 -39.51 3 3 1 40 227.353 2 ↓
Hi High (pH 8-9.5) 0.68 1.14 -3.59 2 3 0 38 226.345 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,3S)-4-methyl-3-(5-methyl-2-thienyl)morpholin-2-yl]methanamine [(2R,3S)-4-methyl-3-(5-methyl-2-…

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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) 0.68 1.47 -39.49 3 3 1 40 227.353 2 ↓
Hi High (pH 8-9.5) 0.68 1.02 -3.84 2 3 0 38 226.345 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,3R)-4-methyl-3-(5-methyl-2-thienyl)morpholin-2-yl]methanamine [(2R,3R)-4-methyl-3-(5-methyl-2-…

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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) 0.68 1.56 -38.92 3 3 1 40 227.353 2 ↓
Hi High (pH 8-9.5) 0.68 1.1 -3.27 2 3 0 38 226.345 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,3R)-3-(4-bromo-2-thienyl)-4-methyl-morpholin-2-yl]methanamine [(2R,3R)-3-(4-bromo-2-thienyl)-4…

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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 1.35 -41.12 3 3 1 40 292.222 2 ↓
Hi High (pH 8-9.5) 1.20 0.98 -2.73 2 3 0 38 291.214 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,3R)-3-(4-bromo-2-thienyl)-4-methyl-morpholin-2-yl]methanamine [(2S,3R)-3-(4-bromo-2-thienyl)-4…

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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 1.3 -40.1 3 3 1 40 292.222 2 ↓
Hi High (pH 8-9.5) 1.20 0.84 -3.18 2 3 0 38 291.214 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-methyl-1-[(2R,3R)-4-methyl-3-(2-thienyl)morpholin-2-yl]methanamine N-methyl-1-[(2R,3R)-4-methyl-3-(…

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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 2.61 -34.16 2 3 1 29 227.353 3 ↓
Hi High (pH 8-9.5) 1.44 1.1 -2.94 1 3 0 24 226.345 3 ↓

Analogs

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Popular Name: N-methyl-1-[(2S,3R)-4-methyl-3-(2-thienyl)morpholin-2-yl]methanamine N-methyl-1-[(2S,3R)-4-methyl-3-(…

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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 2.55 -34.64 2 3 1 29 227.353 3 ↓
Hi High (pH 8-9.5) 1.44 1.12 -3.02 1 3 0 24 226.345 3 ↓

Analogs

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Popular Name: N-methyl-1-[(2R,3S)-4-methyl-3-(2-thienyl)morpholin-2-yl]methanamine N-methyl-1-[(2R,3S)-4-methyl-3-(…

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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 2.51 -34.68 2 3 1 29 227.353 3 ↓
Hi High (pH 8-9.5) 1.44 1 -3.33 1 3 0 24 226.345 3 ↓

Analogs

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Popular Name: N-methyl-1-[(2S,3S)-4-methyl-3-(2-thienyl)morpholin-2-yl]methanamine N-methyl-1-[(2S,3S)-4-methyl-3-(…

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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 2.73 -34.18 2 3 1 29 227.353 3 ↓
Hi High (pH 8-9.5) 1.44 1.29 -2.77 1 3 0 24 226.345 3 ↓

Analogs

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Popular Name: 1-[(2R,3R)-3-(5-bromo-2-thienyl)-4-methyl-morpholin-2-yl]-N-methyl-methanamine 1-[(2R,3R)-3-(5-bromo-2-thienyl)…

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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) 2.37 3.34 -35.39 2 3 1 29 306.249 3 ↓
Hi High (pH 8-9.5) 2.37 1.83 -2.53 1 3 0 24 305.241 3 ↓

Analogs

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Popular Name: 1-[(2S,3R)-3-(5-bromo-2-thienyl)-4-methyl-morpholin-2-yl]-N-methyl-methanamine 1-[(2S,3R)-3-(5-bromo-2-thienyl)…

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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) 2.37 3.28 -36.62 2 3 1 29 306.249 3 ↓
Hi High (pH 8-9.5) 2.37 1.84 -2.59 1 3 0 24 305.241 3 ↓

Analogs

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Popular Name: 1-[(2R,3S)-3-(5-bromo-2-thienyl)-4-methyl-morpholin-2-yl]-N-methyl-methanamine 1-[(2R,3S)-3-(5-bromo-2-thienyl)…

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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) 2.37 3.24 -36.7 2 3 1 29 306.249 3 ↓
Hi High (pH 8-9.5) 2.37 1.73 -2.9 1 3 0 24 305.241 3 ↓

Analogs

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Popular Name: 1-[(2S,3S)-3-(5-bromo-2-thienyl)-4-methyl-morpholin-2-yl]-N-methyl-methanamine 1-[(2S,3S)-3-(5-bromo-2-thienyl)…

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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) 2.37 3.46 -35.43 2 3 1 29 306.249 3 ↓
Hi High (pH 8-9.5) 2.37 2.02 -2.37 1 3 0 24 305.241 3 ↓

Analogs

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Popular Name: N-methyl-1-[(2S,3S)-4-methyl-3-(5-methyl-2-thienyl)morpholin-2-yl]methanamine N-methyl-1-[(2S,3S)-4-methyl-3-(…

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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) 1.66 3.56 -34.16 2 3 1 29 241.38 3 ↓
Hi High (pH 8-9.5) 1.66 2.06 -3.04 1 3 0 24 240.372 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-methyl-1-[(2S,3R)-4-methyl-3-(5-methyl-2-thienyl)morpholin-2-yl]methanamine N-methyl-1-[(2S,3R)-4-methyl-3-(…

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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) 1.66 3.38 -34.65 2 3 1 29 241.38 3 ↓
Hi High (pH 8-9.5) 1.66 1.9 -3.49 1 3 0 24 240.372 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-methyl-1-[(2R,3S)-4-methyl-3-(5-methyl-2-thienyl)morpholin-2-yl]methanamine N-methyl-1-[(2R,3S)-4-methyl-3-(…

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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) 1.66 3.35 -34.66 2 3 1 29 241.38 3 ↓
Hi High (pH 8-9.5) 1.66 1.91 -3.3 1 3 0 24 240.372 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-methyl-1-[(2R,3R)-4-methyl-3-(5-methyl-2-thienyl)morpholin-2-yl]methanamine N-methyl-1-[(2R,3R)-4-methyl-3-(…

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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) 1.66 3.44 -34.18 2 3 1 29 241.38 3 ↓
Hi High (pH 8-9.5) 1.66 1.99 -2.94 1 3 0 24 240.372 3 ↓

Analogs

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Popular Name: N-methyl-1-[(2S,3S)-4-methyl-3-(3-methyl-2-thienyl)morpholin-2-yl]methanamine N-methyl-1-[(2S,3S)-4-methyl-3-(…

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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) 1.82 3.21 -34.17 2 3 1 29 241.38 3 ↓
Hi High (pH 8-9.5) 1.82 1.71 -2.96 1 3 0 24 240.372 3 ↓

Analogs

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Popular Name: N-methyl-1-[(2S,3R)-4-methyl-3-(3-methyl-2-thienyl)morpholin-2-yl]methanamine N-methyl-1-[(2S,3R)-4-methyl-3-(…

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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) 1.82 3.05 -34.81 2 3 1 29 241.38 3 ↓
Hi High (pH 8-9.5) 1.82 1.56 -3.5 1 3 0 24 240.372 3 ↓

Analogs

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Popular Name: N-methyl-1-[(2R,3S)-4-methyl-3-(3-methyl-2-thienyl)morpholin-2-yl]methanamine N-methyl-1-[(2R,3S)-4-methyl-3-(…

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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) 1.82 3.06 -34.87 2 3 1 29 241.38 3 ↓
Hi High (pH 8-9.5) 1.82 1.62 -3.24 1 3 0 24 240.372 3 ↓

Analogs

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Popular Name: N-methyl-1-[(2R,3R)-4-methyl-3-(3-methyl-2-thienyl)morpholin-2-yl]methanamine N-methyl-1-[(2R,3R)-4-methyl-3-(…

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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) 1.82 3.07 -34.23 2 3 1 29 241.38 3 ↓
Hi High (pH 8-9.5) 1.82 1.64 -2.91 1 3 0 24 240.372 3 ↓

Analogs

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Popular Name: 1-[(2R,3R)-3-(4-bromo-2-thienyl)-4-methyl-morpholin-2-yl]-N-methyl-methanamine 1-[(2R,3R)-3-(4-bromo-2-thienyl)…

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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) 2.18 3.22 -36.28 2 3 1 29 306.249 3 ↓
Hi High (pH 8-9.5) 2.18 1.72 -2.65 1 3 0 24 305.241 3 ↓

Analogs

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Popular Name: 1-[(2S,3R)-3-(4-bromo-2-thienyl)-4-methyl-morpholin-2-yl]-N-methyl-methanamine 1-[(2S,3R)-3-(4-bromo-2-thienyl)…

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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) 2.18 3.17 -35.23 2 3 1 29 306.249 3 ↓
Hi High (pH 8-9.5) 2.18 1.74 -2.54 1 3 0 24 305.241 3 ↓

Analogs

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Popular Name: 1-[(2R,3S)-3-(4-bromo-2-thienyl)-4-methyl-morpholin-2-yl]-N-methyl-methanamine 1-[(2R,3S)-3-(4-bromo-2-thienyl)…

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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) 2.18 3.12 -35.25 2 3 1 29 306.249 3 ↓
Hi High (pH 8-9.5) 2.18 1.61 -2.95 1 3 0 24 305.241 3 ↓

Analogs

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Popular Name: 1-[(2S,3S)-3-(4-bromo-2-thienyl)-4-methyl-morpholin-2-yl]-N-methyl-methanamine 1-[(2S,3S)-3-(4-bromo-2-thienyl)…

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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) 2.18 3.34 -36.26 2 3 1 29 306.249 3 ↓
Hi High (pH 8-9.5) 2.18 1.9 -2.52 1 3 0 24 305.241 3 ↓

Analogs

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Popular Name: N-[[(2R,3R)-4-methyl-3-(2-thienyl)morpholin-2-yl]methyl]ethanamine N-[[(2R,3R)-4-methyl-3-(2-thieny…

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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) 1.47 3.47 -32.8 2 3 1 29 241.38 4 ↓
Hi High (pH 8-9.5) 1.47 2.04 -2.75 1 3 0 24 240.372 4 ↓
Lo Low (pH 4.5-6) 1.47 5.54 -95.67 3 3 2 30 242.388 4 ↓

Analogs

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Popular Name: N-[[(2S,3R)-4-methyl-3-(2-thienyl)morpholin-2-yl]methyl]ethanamine N-[[(2S,3R)-4-methyl-3-(2-thieny…

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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) 1.47 3.4 -33.63 2 3 1 29 241.38 4 ↓
Hi High (pH 8-9.5) 1.47 2.05 -2.87 1 3 0 24 240.372 4 ↓
Lo Low (pH 4.5-6) 1.47 5.76 -92.15 3 3 2 30 242.388 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(2R,3S)-4-methyl-3-(2-thienyl)morpholin-2-yl]methyl]ethanamine N-[[(2R,3S)-4-methyl-3-(2-thieny…

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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) 1.47 3.37 -33.61 2 3 1 29 241.38 4 ↓
Hi High (pH 8-9.5) 1.47 1.93 -3.2 1 3 0 24 240.372 4 ↓
Lo Low (pH 4.5-6) 1.47 5.72 -92.1 3 3 2 30 242.388 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(2S,3S)-4-methyl-3-(2-thienyl)morpholin-2-yl]methyl]ethanamine N-[[(2S,3S)-4-methyl-3-(2-thieny…

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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) 1.47 3.58 -32.82 2 3 1 29 241.38 4 ↓
Hi High (pH 8-9.5) 1.47 2.22 -2.56 1 3 0 24 240.372 4 ↓
Lo Low (pH 4.5-6) 1.47 5.59 -95.89 3 3 2 30 242.388 4 ↓

Analogs

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Popular Name: [(2R,3R)-4-ethyl-3-(2-thienyl)morpholin-2-yl]methanamine [(2R,3R)-4-ethyl-3-(2-thienyl)mo…

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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) 0.84 1.52 -38.96 3 3 1 40 227.353 3 ↓
Hi High (pH 8-9.5) 0.84 1.06 -2.92 2 3 0 38 226.345 3 ↓

Analogs

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Popular Name: [(2S,3R)-4-ethyl-3-(2-thienyl)morpholin-2-yl]methanamine [(2S,3R)-4-ethyl-3-(2-thienyl)mo…

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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) 0.84 1.47 -39.45 3 3 1 40 227.353 3 ↓
Hi High (pH 8-9.5) 0.84 1.1 -3.13 2 3 0 38 226.345 3 ↓

Analogs

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Popular Name: [(2R,3R)-3-(5-bromo-2-thienyl)-4-ethyl-morpholin-2-yl]methanamine [(2R,3R)-3-(5-bromo-2-thienyl)-4…

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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) 1.77 2.25 -40.26 3 3 1 40 306.249 3 ↓
Hi High (pH 8-9.5) 1.77 1.88 -2.27 2 3 0 38 305.241 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,3R)-3-(5-bromo-2-thienyl)-4-ethyl-morpholin-2-yl]methanamine [(2S,3R)-3-(5-bromo-2-thienyl)-4…

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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) 1.77 2.2 -41.57 3 3 1 40 306.249 3 ↓
Hi High (pH 8-9.5) 1.77 1.74 -2.97 2 3 0 38 305.241 3 ↓

Parameters Provided:

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filter.purchasability = annotated
page.format = targets
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Structural Results Found: (before additional filtering)

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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 = 26422 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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