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Analogs

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Popular Name: (1R,2S,4S)-N-[(2,6-dimethylimidazo[2,1-b]thiazol-5-yl)methyl]-2,4-dimethyl-cyclohexanamine (1R,2S,4S)-N-[(2,6-dimethylimida…

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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) 3.43 10.19 -44.5 2 3 1 34 292.472 3 ↓
Hi High (pH 8-9.5) 3.43 9.35 -7.62 1 3 0 29 291.464 3 ↓

Analogs

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Popular Name: (1S,2S,4S)-N-[(2,6-dimethylimidazo[2,1-b]thiazol-5-yl)methyl]-2,4-dimethyl-cyclohexanamine (1S,2S,4S)-N-[(2,6-dimethylimida…

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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) 3.43 9.97 -46.02 2 3 1 34 292.472 3 ↓
Hi High (pH 8-9.5) 3.43 9 -7.56 1 3 0 29 291.464 3 ↓

Analogs

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Popular Name: (1R,2S,4R)-N-[(2,6-dimethylimidazo[2,1-b]thiazol-5-yl)methyl]-2,4-dimethyl-cyclohexanamine (1R,2S,4R)-N-[(2,6-dimethylimida…

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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) 3.43 9.77 -46.54 2 3 1 34 292.472 3 ↓
Hi High (pH 8-9.5) 3.43 8.74 -7.59 1 3 0 29 291.464 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2S,4R)-N-[(2,6-dimethylimidazo[2,1-b]thiazol-5-yl)methyl]-2,4-dimethyl-cyclohexanamine (1S,2S,4R)-N-[(2,6-dimethylimida…

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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) 3.43 9.75 -46.1 2 3 1 34 292.472 3 ↓
Hi High (pH 8-9.5) 3.43 8.78 -7.59 1 3 0 29 291.464 3 ↓

Analogs

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Popular Name: (1S,2R,4R)-N-[(6-methoxyimidazo[2,1-b]thiazol-5-yl)methyl]-2,4-dimethyl-cyclohexanamine (1S,2R,4R)-N-[(6-methoxyimidazo[…

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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) 3.17 6.98 -39.71 2 4 1 43 294.444 4 ↓
Hi High (pH 8-9.5) 3.17 6.15 -7.59 1 4 0 39 293.436 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2R,4S)-N-[(6-methoxyimidazo[2,1-b]thiazol-5-yl)methyl]-2,4-dimethyl-cyclohexanamine (1S,2R,4S)-N-[(6-methoxyimidazo[…

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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) 3.17 6.58 -41.99 2 4 1 43 294.444 4 ↓
Hi High (pH 8-9.5) 3.17 5.55 -7.8 1 4 0 39 293.436 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2R,4R)-N-[(6-methoxyimidazo[2,1-b]thiazol-5-yl)methyl]-2,4-dimethyl-cyclohexanamine (1R,2R,4R)-N-[(6-methoxyimidazo[…

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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) 3.17 6.78 -41.75 2 4 1 43 294.444 4 ↓
Hi High (pH 8-9.5) 3.17 5.8 -7.66 1 4 0 39 293.436 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2R,4S)-N-[(6-methoxyimidazo[2,1-b]thiazol-5-yl)methyl]-2,4-dimethyl-cyclohexanamine (1R,2R,4S)-N-[(6-methoxyimidazo[…

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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) 3.17 6.55 -41.86 2 4 1 43 294.444 4 ↓
Hi High (pH 8-9.5) 3.17 5.57 -7.64 1 4 0 39 293.436 4 ↓

Analogs

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Popular Name: (1R,2S,4S)-2,4-dimethyl-N-[(6-methylimidazo[2,1-b]thiazol-5-yl)methyl]cyclohexanamine (1R,2S,4S)-2,4-dimethyl-N-[(6-me…

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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) 3.21 9.3 -45.09 2 3 1 34 278.445 3 ↓
Hi High (pH 8-9.5) 3.21 8.55 -8.01 1 3 0 29 277.437 3 ↓

Analogs

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Popular Name: (1S,2S,4S)-2,4-dimethyl-N-[(6-methylimidazo[2,1-b]thiazol-5-yl)methyl]cyclohexanamine (1S,2S,4S)-2,4-dimethyl-N-[(6-me…

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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) 3.21 9.17 -46.85 2 3 1 34 278.445 3 ↓
Hi High (pH 8-9.5) 3.21 8.2 -8.02 1 3 0 29 277.437 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2S,4R)-2,4-dimethyl-N-[(6-methylimidazo[2,1-b]thiazol-5-yl)methyl]cyclohexanamine (1R,2S,4R)-2,4-dimethyl-N-[(6-me…

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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) 3.21 8.98 -47.41 2 3 1 34 278.445 3 ↓
Hi High (pH 8-9.5) 3.21 7.94 -8.04 1 3 0 29 277.437 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2S,4R)-2,4-dimethyl-N-[(6-methylimidazo[2,1-b]thiazol-5-yl)methyl]cyclohexanamine (1S,2S,4R)-2,4-dimethyl-N-[(6-me…

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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) 3.21 8.94 -46.93 2 3 1 34 278.445 3 ↓
Hi High (pH 8-9.5) 3.21 7.97 -8.02 1 3 0 29 277.437 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2S,4S)-N-[(3,6-dimethylimidazo[2,1-b]thiazol-5-yl)methyl]-2,4-dimethyl-cyclohexanamine (1R,2S,4S)-N-[(3,6-dimethylimida…

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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) 3.43 9.73 -43.87 2 3 1 34 292.472 3 ↓
Hi High (pH 8-9.5) 3.43 8.9 -8.06 1 3 0 29 291.464 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2S,4S)-N-[(3,6-dimethylimidazo[2,1-b]thiazol-5-yl)methyl]-2,4-dimethyl-cyclohexanamine (1S,2S,4S)-N-[(3,6-dimethylimida…

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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) 3.43 9.49 -45.24 2 3 1 34 292.472 3 ↓
Hi High (pH 8-9.5) 3.43 8.53 -8.06 1 3 0 29 291.464 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2S,4R)-N-[(3,6-dimethylimidazo[2,1-b]thiazol-5-yl)methyl]-2,4-dimethyl-cyclohexanamine (1R,2S,4R)-N-[(3,6-dimethylimida…

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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) 3.43 9.31 -45.93 2 3 1 34 292.472 3 ↓
Hi High (pH 8-9.5) 3.43 8.27 -8 1 3 0 29 291.464 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2S,4R)-N-[(3,6-dimethylimidazo[2,1-b]thiazol-5-yl)methyl]-2,4-dimethyl-cyclohexanamine (1S,2S,4R)-N-[(3,6-dimethylimida…

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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) 3.43 9.28 -45.28 2 3 1 34 292.472 3 ↓
Hi High (pH 8-9.5) 3.43 8.3 -8.07 1 3 0 29 291.464 3 ↓

Analogs

53113785
53113785
53116594
53116594
53116597
53116597
53116600
53116600
53116603
53116603

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Popular Name: N-[(3,6-dimethylimidazo[2,1-b]thiazol-5-yl)methyl]-4-methyl-cyclohexanamine N-[(3,6-dimethylimidazo[2,1-b]th…

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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) 2.96 8.63 -46.47 2 3 1 34 278.445 3 ↓

Analogs

53113788
53113788

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Popular Name: 4-methyl-N-[(6-methylimidazo[2,1-b]thiazol-5-yl)methyl]cyclohexanamine 4-methyl-N-[(6-methylimidazo[2,1…

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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) 2.73 8.3 -48.1 2 3 1 34 264.418 3 ↓

Analogs

53113826
53113826
53116778
53116778
53116781
53116781
53116783
53116783
53116785
53116785

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Popular Name: N-[(6-methoxyimidazo[2,1-b]thiazol-5-yl)methyl]-4-methyl-cyclohexanamine N-[(6-methoxyimidazo[2,1-b]thiaz…

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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) 2.69 5.89 -42.76 2 4 1 43 280.417 4 ↓

Analogs

53113785
53113785

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Popular Name: 4-[(3,6-dimethylimidazo[2,1-b]thiazol-5-yl)methylamino]cyclohexanol 4-[(3,6-dimethylimidazo[2,1-b]th…

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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) 1.56 4.89 -49.77 3 4 1 54 280.417 3 ↓

Analogs

53113788
53113788

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Popular Name: 4-[(6-methylimidazo[2,1-b]thiazol-5-yl)methylamino]cyclohexanol 4-[(6-methylimidazo[2,1-b]thiazo…

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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) 1.34 4.56 -51.37 3 4 1 54 266.39 3 ↓

Analogs

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Popular Name: 4-[(6-methoxyimidazo[2,1-b]thiazol-5-yl)methylamino]cyclohexanol 4-[(6-methoxyimidazo[2,1-b]thiaz…

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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) 1.30 2.16 -46.36 3 5 1 63 282.389 4 ↓

Analogs

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Popular Name: (1R,2S)-N-[(3,6-dimethylimidazo[2,1-b]thiazol-5-yl)methyl]-2-methyl-cyclohexanamine (1R,2S)-N-[(3,6-dimethylimidazo[…

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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) 3.42 8.72 -45.21 2 3 1 34 278.445 3 ↓

Analogs

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Popular Name: (1S,2S)-N-[(3,6-dimethylimidazo[2,1-b]thiazol-5-yl)methyl]-2-methyl-cyclohexanamine (1S,2S)-N-[(3,6-dimethylimidazo[…

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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) 3.42 8.88 -44.54 2 3 1 34 278.445 3 ↓

Analogs

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Popular Name: (1R,2R)-N-[(3,6-dimethylimidazo[2,1-b]thiazol-5-yl)methyl]-2-methyl-cyclohexanamine (1R,2R)-N-[(3,6-dimethylimidazo[…

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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) 3.42 8.9 -44.58 2 3 1 34 278.445 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2R)-N-[(3,6-dimethylimidazo[2,1-b]thiazol-5-yl)methyl]-2-methyl-cyclohexanamine (1S,2R)-N-[(3,6-dimethylimidazo[…

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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) 3.42 8.71 -45.04 2 3 1 34 278.445 3 ↓

Analogs

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Popular Name: (1R,2S)-2-methyl-N-[(6-methylimidazo[2,1-b]thiazol-5-yl)methyl]cyclohexanamine (1R,2S)-2-methyl-N-[(6-methylimi…

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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) 3.20 8.38 -46.74 2 3 1 34 264.418 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2S)-2-methyl-N-[(6-methylimidazo[2,1-b]thiazol-5-yl)methyl]cyclohexanamine (1S,2S)-2-methyl-N-[(6-methylimi…

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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) 3.20 8.56 -46.11 2 3 1 34 264.418 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2R)-2-methyl-N-[(6-methylimidazo[2,1-b]thiazol-5-yl)methyl]cyclohexanamine (1R,2R)-2-methyl-N-[(6-methylimi…

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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) 3.20 8.57 -46.16 2 3 1 34 264.418 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2R)-2-methyl-N-[(6-methylimidazo[2,1-b]thiazol-5-yl)methyl]cyclohexanamine (1S,2R)-2-methyl-N-[(6-methylimi…

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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) 3.20 8.37 -46.74 2 3 1 34 264.418 3 ↓

Analogs

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Popular Name: (1S,2R)-N-[(6-methoxyimidazo[2,1-b]thiazol-5-yl)methyl]-2-methyl-cyclohexanamine (1S,2R)-N-[(6-methoxyimidazo[2,1…

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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) 3.16 5.97 -41.38 2 4 1 43 280.417 4 ↓

Analogs

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Popular Name: (1S,2S)-N-[(6-methoxyimidazo[2,1-b]thiazol-5-yl)methyl]-2-methyl-cyclohexanamine (1S,2S)-N-[(6-methoxyimidazo[2,1…

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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) 3.16 6.17 -41.09 2 4 1 43 280.417 4 ↓

Analogs

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Popular Name: (1R,2R)-N-[(6-methoxyimidazo[2,1-b]thiazol-5-yl)methyl]-2-methyl-cyclohexanamine (1R,2R)-N-[(6-methoxyimidazo[2,1…

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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) 3.16 6.17 -41.16 2 4 1 43 280.417 4 ↓

Analogs

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Popular Name: (1R,2S)-N-[(6-methoxyimidazo[2,1-b]thiazol-5-yl)methyl]-2-methyl-cyclohexanamine (1R,2S)-N-[(6-methoxyimidazo[2,1…

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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) 3.16 5.98 -42.01 2 4 1 43 280.417 4 ↓

Analogs

42858969
42858969
42858972
42858972
42858975
42858975
42858976
42858976
53116594
53116594

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Popular Name: (1R,2S,3S)-N-[(3,6-dimethylimidazo[2,1-b]thiazol-5-yl)methyl]-2,3-dimethyl-cyclohexanamine (1R,2S,3S)-N-[(3,6-dimethylimida…

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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) 3.67 9.18 -45.83 2 3 1 34 292.472 3 ↓

Analogs

42858969
42858969
42858972
42858972
42858975
42858975
42858976
42858976
53116594
53116594

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2S,3S)-N-[(3,6-dimethylimidazo[2,1-b]thiazol-5-yl)methyl]-2,3-dimethyl-cyclohexanamine (1S,2S,3S)-N-[(3,6-dimethylimida…

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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) 3.67 9.12 -44.95 2 3 1 34 292.472 3 ↓

Analogs

42858969
42858969
42858972
42858972
42858975
42858975
42858976
42858976
44516475
44516475

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2S,3R)-N-[(3,6-dimethylimidazo[2,1-b]thiazol-5-yl)methyl]-2,3-dimethyl-cyclohexanamine (1R,2S,3R)-N-[(3,6-dimethylimida…

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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) 3.67 9.58 -43.92 2 3 1 34 292.472 3 ↓

Analogs

42858969
42858969
42858972
42858972
42858975
42858975
42858976
42858976
53116594
53116594

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2S,3R)-N-[(3,6-dimethylimidazo[2,1-b]thiazol-5-yl)methyl]-2,3-dimethyl-cyclohexanamine (1S,2S,3R)-N-[(3,6-dimethylimida…

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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) 3.67 9.36 -45.14 2 3 1 34 292.472 3 ↓

Analogs

53116609
53116609
53116612
53116612
53116614
53116614
53116617
53116617

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2S,3S)-2,3-dimethyl-N-[(6-methylimidazo[2,1-b]thiazol-5-yl)methyl]cyclohexanamine (1R,2S,3S)-2,3-dimethyl-N-[(6-me…

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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) 3.44 8.84 -47.32 2 3 1 34 278.445 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2S,3S)-2,3-dimethyl-N-[(6-methylimidazo[2,1-b]thiazol-5-yl)methyl]cyclohexanamine (1S,2S,3S)-2,3-dimethyl-N-[(6-me…

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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) 3.44 8.8 -46.49 2 3 1 34 278.445 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2S,3R)-2,3-dimethyl-N-[(6-methylimidazo[2,1-b]thiazol-5-yl)methyl]cyclohexanamine (1R,2S,3R)-2,3-dimethyl-N-[(6-me…

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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) 3.44 9.16 -45.18 2 3 1 34 278.445 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2S,3R)-2,3-dimethyl-N-[(6-methylimidazo[2,1-b]thiazol-5-yl)methyl]cyclohexanamine (1S,2S,3R)-2,3-dimethyl-N-[(6-me…

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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) 3.44 9.03 -46.73 2 3 1 34 278.445 3 ↓

Analogs

53116778
53116778
53116781
53116781
53116783
53116783
53116785
53116785

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2R,3R)-N-[(6-methoxyimidazo[2,1-b]thiazol-5-yl)methyl]-2,3-dimethyl-cyclohexanamine (1S,2R,3R)-N-[(6-methoxyimidazo[…

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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) 3.40 6.45 -41.91 2 4 1 43 294.444 4 ↓

Analogs

53116778
53116778
53116781
53116781
53116783
53116783
53116785
53116785

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2R,3S)-N-[(6-methoxyimidazo[2,1-b]thiazol-5-yl)methyl]-2,3-dimethyl-cyclohexanamine (1S,2R,3S)-N-[(6-methoxyimidazo[…

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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) 3.40 6.84 -39.76 2 4 1 43 294.444 4 ↓

Analogs

53116778
53116778
53116781
53116781
53116783
53116783
53116785
53116785

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2R,3R)-N-[(6-methoxyimidazo[2,1-b]thiazol-5-yl)methyl]-2,3-dimethyl-cyclohexanamine (1R,2R,3R)-N-[(6-methoxyimidazo[…

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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) 3.40 6.4 -41.43 2 4 1 43 294.444 4 ↓

Analogs

53116778
53116778
53116781
53116781
53116783
53116783
53116785
53116785

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2R,3S)-N-[(6-methoxyimidazo[2,1-b]thiazol-5-yl)methyl]-2,3-dimethyl-cyclohexanamine (1R,2R,3S)-N-[(6-methoxyimidazo[…

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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) 3.40 6.64 -41.76 2 4 1 43 294.444 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2R)-N-[(3,6-dimethylimidazo[2,1-b]thiazol-5-yl)methyl]-2-ethyl-cyclohexanamine (1S,2R)-N-[(3,6-dimethylimidazo[…

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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) 3.93 9.6 -43.85 2 3 1 34 292.472 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2S)-N-[(3,6-dimethylimidazo[2,1-b]thiazol-5-yl)methyl]-2-ethyl-cyclohexanamine (1S,2S)-N-[(3,6-dimethylimidazo[…

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Activity (Go SEA)

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) 3.93 9.53 -45.38 2 3 1 34 292.472 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2R)-N-[(3,6-dimethylimidazo[2,1-b]thiazol-5-yl)methyl]-2-ethyl-cyclohexanamine (1R,2R)-N-[(3,6-dimethylimidazo[…

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Activity (Go SEA)

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) 3.93 9.54 -45.38 2 3 1 34 292.472 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2S)-N-[(3,6-dimethylimidazo[2,1-b]thiazol-5-yl)methyl]-2-ethyl-cyclohexanamine (1R,2S)-N-[(3,6-dimethylimidazo[…

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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) 3.93 9.74 -44.18 2 3 1 34 292.472 4 ↓

Parameters Provided:

ring.id = 524032
filter.purchasability = annotated
page.format = targets
page.num = 1

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 = 524032 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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