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Analogs

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Popular Name: 2-(3,4-dihydro-2H-quinolin-1-yl)thiazole-5-carbaldehyde 2-(3,4-dihydro-2H-quinolin-1-yl)…

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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) 3.33 8.22 -10.03 0 3 0 33 244.319 2 ↓

Analogs

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Popular Name: 1-[2-(3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]ethanone 1-[2-(3,4-dihydro-2H-quinolin-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) 3.44 7.96 -10.05 0 3 0 33 258.346 2 ↓

Analogs

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Popular Name: 2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)thiazole-5-carbaldehyde 2-(6-methyl-3,4-dihydro-2H-quino…

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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) 3.76 8.88 -10.09 0 3 0 33 258.346 2 ↓

Analogs

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Popular Name: 1-[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]ethanone 1-[2-(6-methyl-3,4-dihydro-2H-qu…

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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) 3.86 9.56 -10.39 0 3 0 33 272.373 2 ↓

Analogs

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Popular Name: 1-[4-methyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]ethanone 1-[4-methyl-2-(6-methyl-3,4-dihy…

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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) 4.09 10.22 -9.81 0 3 0 33 286.4 2 ↓

Analogs

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Popular Name: (1R)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)-4-methyl-thiazol-5-yl]ethanamine (1R)-1-[2-(3,4-dihydro-2H-quinol…

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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) 1.63 7.68 -48.12 3 3 1 44 274.413 2 ↓
Mid Mid (pH 6-8) 1.63 7.34 -7.2 2 3 0 42 273.405 2 ↓

Analogs

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Popular Name: (1S)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)-4-methyl-thiazol-5-yl]ethanamine (1S)-1-[2-(3,4-dihydro-2H-quinol…

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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) 1.63 7.69 -47.78 3 3 1 44 274.413 2 ↓
Mid Mid (pH 6-8) 1.63 7.36 -8.12 2 3 0 42 273.405 2 ↓

Analogs

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Popular Name: [2-(3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]methanamine [2-(3,4-dihydro-2H-quinolin-1-yl…

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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 6.53 -49.23 3 3 1 44 246.359 2 ↓
Mid Mid (pH 6-8) 2.73 6.13 -7.76 2 3 0 42 245.351 2 ↓

Analogs

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Popular Name: (1S)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]ethanamine (1S)-1-[2-(3,4-dihydro-2H-quinol…

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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) 1.41 7.2 -47.44 3 3 1 44 260.386 2 ↓
Mid Mid (pH 6-8) 1.41 6.87 -7.54 2 3 0 42 259.378 2 ↓

Analogs

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Popular Name: (1R)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]ethanamine (1R)-1-[2-(3,4-dihydro-2H-quinol…

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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) 1.41 7.2 -47.41 3 3 1 44 260.386 2 ↓
Mid Mid (pH 6-8) 1.41 6.86 -7.25 2 3 0 42 259.378 2 ↓

Analogs

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Popular Name: (1R)-1-[4-methyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]ethanamine (1R)-1-[4-methyl-2-(6-methyl-3,4…

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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) 2.05 8.35 -48.12 3 3 1 44 288.44 2 ↓
Mid Mid (pH 6-8) 2.05 8.01 -7.24 2 3 0 42 287.432 2 ↓

Analogs

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Popular Name: (1S)-1-[4-methyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]ethanamine (1S)-1-[4-methyl-2-(6-methyl-3,4…

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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) 2.05 8.35 -47.79 3 3 1 44 288.44 2 ↓
Mid Mid (pH 6-8) 2.05 8.03 -8.23 2 3 0 42 287.432 2 ↓

Analogs

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Popular Name: [2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]methanamine [2-(6-methyl-3,4-dihydro-2H-quin…

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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) 3.15 7.2 -49.21 3 3 1 44 260.386 2 ↓
Mid Mid (pH 6-8) 3.15 6.8 -7.87 2 3 0 42 259.378 2 ↓

Analogs

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Popular Name: (1R)-1-[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]ethanamine (1R)-1-[2-(6-methyl-3,4-dihydro-…

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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) 1.83 7.87 -47.39 3 3 1 44 274.413 2 ↓
Mid Mid (pH 6-8) 1.83 7.54 -7.34 2 3 0 42 273.405 2 ↓

Analogs

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Popular Name: (1S)-1-[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]ethanamine (1S)-1-[2-(6-methyl-3,4-dihydro-…

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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) 1.83 7.87 -47.41 3 3 1 44 274.413 2 ↓
Mid Mid (pH 6-8) 1.83 7.53 -7.62 2 3 0 42 273.405 2 ↓

Analogs

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Popular Name: (1R)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)-4-methyl-thiazol-5-yl]-N-methyl-ethanamine (1R)-1-[2-(3,4-dihydro-2H-quinol…

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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) 3.88 9.38 -42.58 2 3 1 33 288.44 3 ↓
Hi High (pH 8-9.5) 3.88 8.11 -7.76 1 3 0 28 287.432 3 ↓

Analogs

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Popular Name: (1S)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)-4-methyl-thiazol-5-yl]-N-methyl-ethanamine (1S)-1-[2-(3,4-dihydro-2H-quinol…

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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) 3.88 9.41 -42.31 2 3 1 33 288.44 3 ↓
Hi High (pH 8-9.5) 3.88 8.1 -6.91 1 3 0 28 287.432 3 ↓

Analogs

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Popular Name: (1S)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)-4-methyl-thiazol-5-yl]-N-ethyl-ethanamine (1S)-1-[2-(3,4-dihydro-2H-quinol…

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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) 4.26 10.22 -41.1 2 3 1 33 302.467 4 ↓
Hi High (pH 8-9.5) 4.26 9.04 -7.58 1 3 0 28 301.459 4 ↓

Analogs

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Popular Name: (1R)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)-4-methyl-thiazol-5-yl]-N-ethyl-ethanamine (1R)-1-[2-(3,4-dihydro-2H-quinol…

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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) 4.26 10.24 -41.01 2 3 1 33 302.467 4 ↓
Hi High (pH 8-9.5) 4.26 9.04 -6.73 1 3 0 28 301.459 4 ↓

Analogs

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Popular Name: 1-[2-(3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]-N-methyl-methanamine 1-[2-(3,4-dihydro-2H-quinolin-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) 3.10 8.4 -43.53 2 3 1 33 260.386 3 ↓
Hi High (pH 8-9.5) 3.10 6.96 -7.22 1 3 0 28 259.378 3 ↓

Analogs

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Popular Name: N-[[2-(3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]methyl]ethanamine N-[[2-(3,4-dihydro-2H-quinolin-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) 3.48 9.26 -42.6 2 3 1 33 274.413 4 ↓
Hi High (pH 8-9.5) 3.48 7.89 -7.03 1 3 0 28 273.405 4 ↓

Analogs

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Popular Name: N-[[2-(3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]methyl]propan-1-amine N-[[2-(3,4-dihydro-2H-quinolin-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) 3.98 10.02 -43.48 2 3 1 33 288.44 5 ↓
Hi High (pH 8-9.5) 3.98 8.66 -6.9 1 3 0 28 287.432 5 ↓

Analogs

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Popular Name: N-[[2-(3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]methyl]propan-2-amine N-[[2-(3,4-dihydro-2H-quinolin-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) 3.77 9.8 -40.99 2 3 1 33 288.44 4 ↓
Hi High (pH 8-9.5) 3.77 8.59 -6.88 1 3 0 28 287.432 4 ↓

Analogs

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Popular Name: N-[[2-(3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]methyl]-2-methyl-propan-2-amine N-[[2-(3,4-dihydro-2H-quinolin-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) 4.29 10.21 -38.94 2 3 1 33 302.467 4 ↓
Hi High (pH 8-9.5) 4.29 8.97 -6.72 1 3 0 28 301.459 4 ↓

Analogs

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Popular Name: N-[[2-(3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]methyl]-2-methyl-propan-1-amine N-[[2-(3,4-dihydro-2H-quinolin-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) 4.22 10.71 -43.42 2 3 1 33 302.467 5 ↓
Hi High (pH 8-9.5) 4.22 9.49 -6.76 1 3 0 28 301.459 5 ↓

Analogs

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Popular Name: N-[[2-(3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]methyl]-2-methoxy-ethanamine N-[[2-(3,4-dihydro-2H-quinolin-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) 3.08 8.4 -43.05 2 4 1 42 304.439 6 ↓
Mid Mid (pH 6-8) 3.08 7.05 -8.02 1 4 0 37 303.431 6 ↓

Analogs

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Popular Name: (1S)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]-N-methyl-ethanamine (1S)-1-[2-(3,4-dihydro-2H-quinol…

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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) 3.66 8.95 -41.9 2 3 1 33 274.413 3 ↓
Hi High (pH 8-9.5) 3.66 7.67 -6.46 1 3 0 28 273.405 3 ↓

Analogs

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Popular Name: (1R)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]-N-methyl-ethanamine (1R)-1-[2-(3,4-dihydro-2H-quinol…

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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) 3.66 8.94 -41.95 2 3 1 33 274.413 3 ↓
Hi High (pH 8-9.5) 3.66 7.68 -7.31 1 3 0 28 273.405 3 ↓

Analogs

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Popular Name: (1S)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]-N-ethyl-ethanamine (1S)-1-[2-(3,4-dihydro-2H-quinol…

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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) 4.04 9.78 -40.53 2 3 1 33 288.44 4 ↓
Hi High (pH 8-9.5) 4.04 8.62 -7.13 1 3 0 28 287.432 4 ↓

Analogs

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Popular Name: (1R)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]-N-ethyl-ethanamine (1R)-1-[2-(3,4-dihydro-2H-quinol…

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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) 4.04 9.79 -40.55 2 3 1 33 288.44 4 ↓
Hi High (pH 8-9.5) 4.04 8.59 -6.26 1 3 0 28 287.432 4 ↓

Analogs

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Popular Name: N-[(1S)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]ethyl]propan-1-amine N-[(1S)-1-[2-(3,4-dihydro-2H-qui…

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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) 4.54 10.54 -41.25 2 3 1 33 302.467 5 ↓
Hi High (pH 8-9.5) 4.54 9.37 -7.02 1 3 0 28 301.459 5 ↓

Analogs

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Popular Name: N-[(1R)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]ethyl]propan-1-amine N-[(1R)-1-[2-(3,4-dihydro-2H-qui…

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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) 4.54 10.54 -41.3 2 3 1 33 302.467 5 ↓
Hi High (pH 8-9.5) 4.54 9.34 -6.17 1 3 0 28 301.459 5 ↓

Analogs

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Popular Name: (1R)-N-methyl-1-[4-methyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]ethanamine (1R)-N-methyl-1-[4-methyl-2-(6-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) 4.30 10.05 -42.6 2 3 1 33 302.467 3 ↓
Hi High (pH 8-9.5) 4.30 8.79 -7.86 1 3 0 28 301.459 3 ↓

Analogs

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Popular Name: (1S)-N-methyl-1-[4-methyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]ethanamine (1S)-N-methyl-1-[4-methyl-2-(6-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) 4.30 10.07 -42.33 2 3 1 33 302.467 3 ↓
Hi High (pH 8-9.5) 4.30 8.77 -6.93 1 3 0 28 301.459 3 ↓

Analogs

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Popular Name: N-methyl-1-[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]methanamine N-methyl-1-[2-(6-methyl-3,4-dihy…

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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) 3.52 9.07 -43.48 2 3 1 33 274.413 3 ↓
Hi High (pH 8-9.5) 3.52 7.63 -7.11 1 3 0 28 273.405 3 ↓

Analogs

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Popular Name: N-[[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]methyl]ethanamine N-[[2-(6-methyl-3,4-dihydro-2H-q…

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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) 3.90 9.93 -42.65 2 3 1 33 288.44 4 ↓
Hi High (pH 8-9.5) 3.90 8.56 -7.11 1 3 0 28 287.432 4 ↓

Analogs

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Popular Name: N-[[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]methyl]propan-1-amine N-[[2-(6-methyl-3,4-dihydro-2H-q…

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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) 4.40 10.68 -43.42 2 3 1 33 302.467 5 ↓
Hi High (pH 8-9.5) 4.40 9.32 -6.98 1 3 0 28 301.459 5 ↓

Analogs

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Popular Name: N-[[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]methyl]propan-2-amine N-[[2-(6-methyl-3,4-dihydro-2H-q…

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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) 4.20 10.46 -40.83 2 3 1 33 302.467 4 ↓
Hi High (pH 8-9.5) 4.20 9.23 -6.87 1 3 0 28 301.459 4 ↓

Analogs

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Popular Name: (1R)-N-methyl-1-[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]ethanamine (1R)-N-methyl-1-[2-(6-methyl-3,4…

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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) 4.08 9.62 -41.93 2 3 1 33 288.44 3 ↓
Hi High (pH 8-9.5) 4.08 8.35 -7.36 1 3 0 28 287.432 3 ↓

Analogs

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Popular Name: (1S)-N-methyl-1-[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]ethanamine (1S)-N-methyl-1-[2-(6-methyl-3,4…

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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) 4.08 9.62 -41.91 2 3 1 33 288.44 3 ↓
Hi High (pH 8-9.5) 4.08 8.33 -6.53 1 3 0 28 287.432 3 ↓

Analogs

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Popular Name: (1S)-N-ethyl-1-[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]ethanamine (1S)-N-ethyl-1-[2-(6-methyl-3,4-…

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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) 4.46 10.45 -40.52 2 3 1 33 302.467 4 ↓
Hi High (pH 8-9.5) 4.46 9.29 -7.22 1 3 0 28 301.459 4 ↓

Analogs

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Popular Name: (1R)-N-ethyl-1-[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]ethanamine (1R)-N-ethyl-1-[2-(6-methyl-3,4-…

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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) 4.46 10.44 -40.57 2 3 1 33 302.467 4 ↓
Hi High (pH 8-9.5) 4.46 9.25 -6.29 1 3 0 28 301.459 4 ↓

Analogs

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Popular Name: 2-(3,4-dihydro-2H-quinolin-1-yl)thiazole-5-carboxylic 2-(3,4-dihydro-2H-quinolin-1-yl)…

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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) 3.11 9.1 -51.58 0 4 -1 56 259.31 2 ↓

Analogs

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Popular Name: 2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)thiazole-5-carboxylic 2-(6-methyl-3,4-dihydro-2H-quino…

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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) 3.54 9.76 -51.79 0 4 -1 56 273.337 2 ↓

Analogs

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Popular Name: (1R)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)-4-methyl-thiazol-5-yl]ethanol (1R)-1-[2-(3,4-dihydro-2H-quinol…

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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) 3.33 7.08 -8.37 1 3 0 36 274.389 2 ↓

Analogs

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Popular Name: (1S)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)-4-methyl-thiazol-5-yl]ethanol (1S)-1-[2-(3,4-dihydro-2H-quinol…

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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) 3.33 7.09 -8.42 1 3 0 36 274.389 2 ↓

Analogs

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Popular Name: [2-(3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]methanol [2-(3,4-dihydro-2H-quinolin-1-yl…

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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) 2.88 5.79 -9.77 1 3 0 36 246.335 2 ↓

Analogs

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Popular Name: (1S)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]ethanol (1S)-1-[2-(3,4-dihydro-2H-quinol…

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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) 3.10 6.59 -9.48 1 3 0 36 260.362 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]ethanol (1R)-1-[2-(3,4-dihydro-2H-quinol…

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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) 3.10 6.58 -9.5 1 3 0 36 260.362 2 ↓

Analogs

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Popular Name: (1R)-1-[4-methyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]ethanol (1R)-1-[4-methyl-2-(6-methyl-3,4…

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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) 3.75 7.73 -9.76 1 3 0 36 288.416 2 ↓

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