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Analogs

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Popular Name: 4-(4,5-dimethyl-1,2,4-triazol-3-yl)-4-methyl-piperidine 4-(4,5-dimethyl-1,2,4-triazol-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) 0.08 4.67 -51.29 2 4 1 47 195.29 1 ↓

Analogs

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Popular Name: 4-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)-4-methyl-piperidine 4-(4-ethyl-5-methyl-1,2,4-triazo…

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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 5.41 -50.97 2 4 1 47 209.317 2 ↓

Analogs

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Popular Name: 4-methyl-4-(5-methyl-4-propyl-1,2,4-triazol-3-yl)piperidine 4-methyl-4-(5-methyl-4-propyl-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) 0.96 6.16 -50.65 2 4 1 47 223.344 3 ↓

Analogs

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Popular Name: 4-(4-isopropyl-5-methyl-1,2,4-triazol-3-yl)-4-methyl-piperidine 4-(4-isopropyl-5-methyl-1,2,4-tr…

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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) 0.82 5.72 -50.14 2 4 1 47 223.344 2 ↓

Analogs

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Popular Name: 4-methyl-4-(4-methyl-1,2,4-triazol-3-yl)piperidine 4-methyl-4-(4-methyl-1,2,4-triaz…

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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) 0.00 4.87 -50.75 2 4 1 47 181.263 1 ↓

Analogs

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Popular Name: 4-(4-ethyl-1,2,4-triazol-3-yl)-4-methyl-piperidine 4-(4-ethyl-1,2,4-triazol-3-yl)-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) 0.37 5.61 -50.37 2 4 1 47 195.29 2 ↓

Analogs

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Popular Name: 4-methyl-4-(4-propyl-1,2,4-triazol-3-yl)piperidine 4-methyl-4-(4-propyl-1,2,4-triaz…

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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) 0.88 6.37 -50.14 2 4 1 47 209.317 3 ↓

Analogs

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Popular Name: 4-(4-isopropyl-1,2,4-triazol-3-yl)-4-methyl-piperidine 4-(4-isopropyl-1,2,4-triazol-3-y…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.74 6.13 -49.62 2 4 1 47 209.317 2 ↓

Analogs

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Popular Name: 4-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]-4-methyl-piperidine 4-[4-(2-methoxyethyl)-1,2,4-tria…

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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) -0.02 4.67 -49.73 2 5 1 57 225.316 4 ↓

Analogs

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Popular Name: 4-(4-isobutyl-1,2,4-triazol-3-yl)-4-methyl-piperidine 4-(4-isobutyl-1,2,4-triazol-3-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) 1.12 6.1 -49.14 2 4 1 47 223.344 3 ↓

Analogs

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Popular Name: 4-(4,5-dimethyl-1,2,4-triazol-3-yl)-4-propyl-piperidine 4-(4,5-dimethyl-1,2,4-triazol-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) 0.97 5.6 -52.06 2 4 1 47 223.344 3 ↓

Analogs

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Popular Name: 4-(4,5-dimethyl-1,2,4-triazol-3-yl)-4-ethyl-piperidine 4-(4,5-dimethyl-1,2,4-triazol-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) 0.41 4.84 -51.82 2 4 1 47 209.317 2 ↓

Analogs

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Popular Name: 4-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)-4-propyl-piperidine 4-(4-ethyl-5-methyl-1,2,4-triazo…

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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 6.15 -51.86 2 4 1 47 237.371 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-ethyl-4-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)piperidine 4-ethyl-4-(4-ethyl-5-methyl-1,2,…

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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) 0.78 5.49 -51.47 2 4 1 47 223.344 3 ↓

Analogs

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Popular Name: 4-(5-methyl-4-propyl-1,2,4-triazol-3-yl)-4-propyl-piperidine 4-(5-methyl-4-propyl-1,2,4-triaz…

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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) 1.85 6.88 -51.62 2 4 1 47 251.398 5 ↓

Analogs

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Popular Name: 4-ethyl-4-(5-methyl-4-propyl-1,2,4-triazol-3-yl)piperidine 4-ethyl-4-(5-methyl-4-propyl-1,2…

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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) 1.29 6.28 -51.33 2 4 1 47 237.371 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(4-isopropyl-5-methyl-1,2,4-triazol-3-yl)-4-propyl-piperidine 4-(4-isopropyl-5-methyl-1,2,4-tr…

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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) 1.71 6.7 -51.44 2 4 1 47 251.398 4 ↓

Analogs

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Popular Name: 4-ethyl-4-(4-isopropyl-5-methyl-1,2,4-triazol-3-yl)piperidine 4-ethyl-4-(4-isopropyl-5-methyl-…

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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 5.94 -51.14 2 4 1 47 237.371 3 ↓

Analogs

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Popular Name: 4-(4-methyl-1,2,4-triazol-3-yl)-4-propyl-piperidine 4-(4-methyl-1,2,4-triazol-3-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) 0.88 5.79 -51.52 2 4 1 47 209.317 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-ethyl-4-(4-methyl-1,2,4-triazol-3-yl)piperidine 4-ethyl-4-(4-methyl-1,2,4-triazo…

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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) 0.32 5.02 -51.76 2 4 1 47 195.29 2 ↓

Analogs

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Popular Name: 4-(4-ethyl-1,2,4-triazol-3-yl)-4-propyl-piperidine 4-(4-ethyl-1,2,4-triazol-3-yl)-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) 1.26 6.41 -51.32 2 4 1 47 223.344 4 ↓

Analogs

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Popular Name: 4-ethyl-4-(4-ethyl-1,2,4-triazol-3-yl)piperidine 4-ethyl-4-(4-ethyl-1,2,4-triazol…

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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) 0.70 5.73 -50.97 2 4 1 47 209.317 3 ↓

Analogs

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Popular Name: 4-propyl-4-(4-propyl-1,2,4-triazol-3-yl)piperidine 4-propyl-4-(4-propyl-1,2,4-triaz…

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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) 1.76 7.15 -51.23 2 4 1 47 237.371 5 ↓

Analogs

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Popular Name: 4-ethyl-4-(4-propyl-1,2,4-triazol-3-yl)piperidine 4-ethyl-4-(4-propyl-1,2,4-triazo…

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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 6.65 -55.87 2 4 1 47 223.344 4 ↓

Analogs

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Popular Name: 4-(4-isopropyl-1,2,4-triazol-3-yl)-4-propyl-piperidine 4-(4-isopropyl-1,2,4-triazol-3-y…

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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) 1.62 7.06 -51.14 2 4 1 47 237.371 4 ↓

Analogs

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Popular Name: 4-ethyl-4-(4-isopropyl-1,2,4-triazol-3-yl)piperidine 4-ethyl-4-(4-isopropyl-1,2,4-tri…

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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) 1.06 6.29 -50.79 2 4 1 47 223.344 3 ↓

Analogs

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Popular Name: 4-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]-4-propyl-piperidine 4-[4-(2-methoxyethyl)-1,2,4-tria…

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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) 0.86 5.45 -49.89 2 5 1 57 253.37 6 ↓

Analogs

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Popular Name: 4-ethyl-4-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]piperidine 4-ethyl-4-[4-(2-methoxyethyl)-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) 0.30 4.79 -49.6 2 5 1 57 239.343 5 ↓

Analogs

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Popular Name: 4-(4-isobutyl-1,2,4-triazol-3-yl)-4-propyl-piperidine 4-(4-isobutyl-1,2,4-triazol-3-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) 2.00 7.25 -51.29 2 4 1 47 251.398 5 ↓

Analogs

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Popular Name: 4-ethyl-4-(4-isobutyl-1,2,4-triazol-3-yl)piperidine 4-ethyl-4-(4-isobutyl-1,2,4-tria…

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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 6.59 -50.86 2 4 1 47 237.371 4 ↓

Analogs

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Popular Name: 1-[4-(4-ethyl-1,2,4-triazol-3-yl)-1-piperidyl]-2-(2,2,2-trifluoroethoxy)ethanone 1-[4-(4-ethyl-1,2,4-triazol-3-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) 0.57 8.59 -24.09 0 6 0 60 320.315 6 ↓

Analogs

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Popular Name: 1-[4-(4-ethyl-1,2,4-triazol-3-yl)-1-piperidyl]-2-(trifluoromethylsulfanyl)ethanone 1-[4-(4-ethyl-1,2,4-triazol-3-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) 3.74 8.85 -18.04 0 5 0 51 322.356 5 ↓

Analogs

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Popular Name: 1-[4-(4-ethyl-1,2,4-triazol-3-yl)-1-piperidyl]-2-propylsulfanyl-ethanone 1-[4-(4-ethyl-1,2,4-triazol-3-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) 1.07 9.93 -19.38 0 5 0 51 296.44 6 ↓

Analogs

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Popular Name: [4-methyl-5-(4-piperidinyl)-4H-1,2,4-triazol-3-yl]methanol [4-methyl-5-(4-piperidinyl)-4H-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) -1.19 1.25 -51.92 3 5 1 68 197.262 2 ↓

Analogs

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Popular Name: 4-(4,5-dimethyl-1,2,4-triazol-3-yl)piperidine 4-(4,5-dimethyl-1,2,4-triazol-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) -0.54 4.71 -49.32 2 4 1 47 181.263 1 ↓

Analogs

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Popular Name: 4-(4-ethyl-5-methyl-1,2,4-triazol-3-yl)piperidine 4-(4-ethyl-5-methyl-1,2,4-triazo…

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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) -0.16 5.57 -48.82 2 4 1 47 195.29 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(5-methyl-4-propyl-1,2,4-triazol-3-yl)piperidine 4-(5-methyl-4-propyl-1,2,4-triaz…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.34 6.33 -48.48 2 4 1 47 209.317 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(4-isopropyl-5-methyl-1,2,4-triazol-3-yl)piperidine 4-(4-isopropyl-5-methyl-1,2,4-tr…

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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) 0.20 5.78 -48.84 2 4 1 47 209.317 2 ↓

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