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Popular Name: 2-(2-pyrazol-1-ylethylsulfonyl)benzoic 2-(2-pyrazol-1-ylethylsulfonyl)b…

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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) 0.85 4.91 -50.77 0 6 -1 92 279.297 5 ↓

Analogs

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Popular Name: 4-(2-pyrazol-1-ylethylsulfonyl)benzoic 4-(2-pyrazol-1-ylethylsulfonyl)b…

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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) 0.79 4.48 -54.25 0 6 -1 92 279.297 5 ↓

Analogs

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Popular Name: 3-(2-pyrazol-1-ylethylsulfonyl)benzoic 3-(2-pyrazol-1-ylethylsulfonyl)b…

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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) 0.77 4.47 -59.07 0 6 -1 92 279.297 5 ↓

Analogs

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Popular Name: 2-methoxy-5-(2-pyrazol-1-ylethylsulfonyl)benzoic 2-methoxy-5-(2-pyrazol-1-ylethyl…

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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 4.54 -61.28 0 7 -1 101 309.323 6 ↓

Analogs

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Popular Name: 5-bromo-2-fluoro-3-(2-pyrazol-1-ylethylsulfonyl)benzoic 5-bromo-2-fluoro-3-(2-pyrazol-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) 1.72 5.08 -50.28 0 6 -1 92 376.183 5 ↓

Analogs

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Popular Name: 2-bromo-5-(2-pyrazol-1-ylethylsulfonyl)benzoic 2-bromo-5-(2-pyrazol-1-ylethylsu…

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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 4.96 -56.35 0 6 -1 92 358.193 5 ↓

Analogs

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Popular Name: 5-chloro-2-fluoro-3-(2-pyrazol-1-ylethylsulfonyl)benzoic 5-chloro-2-fluoro-3-(2-pyrazol-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) 1.59 4.97 -50.41 0 6 -1 92 331.732 5 ↓

Analogs

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Popular Name: 4-methoxy-3-(2-pyrazol-1-ylethylsulfonyl)benzoic 4-methoxy-3-(2-pyrazol-1-ylethyl…

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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) 1.22 4.29 -59.19 0 7 -1 101 309.323 6 ↓

Analogs

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Popular Name: 3,4-dimethyl-5-(2-pyrazol-1-ylethylsulfonyl)benzoic 3,4-dimethyl-5-(2-pyrazol-1-ylet…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.98 5.61 -59.26 0 6 -1 92 307.351 5 ↓

Analogs

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Popular Name: 2-methyl-5-(2-pyrazol-1-ylethylsulfonyl)benzoic 2-methyl-5-(2-pyrazol-1-ylethyls…

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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) 0.83 5.13 -57.12 0 6 -1 92 293.324 5 ↓

Analogs

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Popular Name: 2,6-dichloro-3-(2-pyrazol-1-ylethylsulfonyl)benzoic 2,6-dichloro-3-(2-pyrazol-1-ylet…

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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) 2.11 5.15 -50.08 0 6 -1 92 348.187 5 ↓

Analogs

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Popular Name: 2,4-dichloro-5-(2-pyrazol-1-ylethylsulfonyl)benzoic 2,4-dichloro-5-(2-pyrazol-1-ylet…

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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) 2.11 5.27 -50.46 0 6 -1 92 348.187 5 ↓

Analogs

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Popular Name: 4-methyl-3-(2-pyrazol-1-ylethylsulfonyl)benzoic 4-methyl-3-(2-pyrazol-1-ylethyls…

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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) 1.61 5.1 -61.4 0 6 -1 92 293.324 5 ↓

Analogs

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Popular Name: 3-[4-(2-pyrazol-1-ylethylsulfonyl)phenyl]propanoic 3-[4-(2-pyrazol-1-ylethylsulfony…

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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 6.06 -52.38 0 6 -1 92 307.351 7 ↓

Analogs

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Popular Name: 2-fluoro-5-(2-pyrazol-1-ylethylsulfonyl)benzoic 2-fluoro-5-(2-pyrazol-1-ylethyls…

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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) 0.55 4.5 -60.83 0 6 -1 92 297.287 5 ↓

Analogs

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Popular Name: 4-fluoro-3-(2-pyrazol-1-ylethylsulfonyl)benzoic 4-fluoro-3-(2-pyrazol-1-ylethyls…

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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) 1.32 4.5 -52.75 0 6 -1 92 297.287 5 ↓

Analogs

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Popular Name: 2,6-difluoro-3-(2-pyrazol-1-ylethylsulfonyl)benzoic 2,6-difluoro-3-(2-pyrazol-1-ylet…

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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) 1.08 4.49 -57.65 0 6 -1 92 315.277 5 ↓

Analogs

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Popular Name: 4-chloro-3-(2-pyrazol-1-ylethylsulfonyl)benzoic 4-chloro-3-(2-pyrazol-1-ylethyls…

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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) 1.84 4.89 -52.71 0 6 -1 92 313.742 5 ↓

Analogs

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Popular Name: 2-chloro-5-(2-pyrazol-1-ylethylsulfonyl)benzoic 2-chloro-5-(2-pyrazol-1-ylethyls…

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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 4.86 -57.18 0 6 -1 92 313.742 5 ↓

Analogs

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Popular Name: 4-bromo-3-(2-pyrazol-1-ylethylsulfonyl)benzoic 4-bromo-3-(2-pyrazol-1-ylethylsu…

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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) 1.97 4.99 -52.44 0 6 -1 92 358.193 5 ↓

Analogs

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Popular Name: 4-ethyl-3-(2-pyrazol-1-ylethylsulfonyl)benzoic 4-ethyl-3-(2-pyrazol-1-ylethylsu…

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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) 2.07 5.68 -60.48 0 6 -1 92 307.351 6 ↓

Analogs

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Popular Name: 2,4-dimethyl-5-(2-pyrazol-1-ylethylsulfonyl)benzoic 2,4-dimethyl-5-(2-pyrazol-1-ylet…

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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) 1.65 5.72 -59.37 0 6 -1 92 307.351 5 ↓

Analogs

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Popular Name: 2-[4-(2-pyrazol-1-ylethylsulfonyl)phenyl]acetic 2-[4-(2-pyrazol-1-ylethylsulfony…

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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) 0.31 5.26 -51.94 0 6 -1 92 293.324 6 ↓

Analogs

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Popular Name: 3-fluoro-4-methyl-5-(2-pyrazol-1-ylethylsulfonyl)benzoic 3-fluoro-4-methyl-5-(2-pyrazol-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) 1.70 5.14 -55.57 0 6 -1 92 311.314 5 ↓

Analogs

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Popular Name: 2,5-dichloro-3-(2-pyrazol-1-ylethylsulfonyl)benzoic 2,5-dichloro-3-(2-pyrazol-1-ylet…

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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) 2.11 5.27 -46.95 0 6 -1 92 348.187 5 ↓

Analogs

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Popular Name: 2-(2-pyrazol-1-ylethylsulfonyl)aniline 2-(2-pyrazol-1-ylethylsulfonyl)a…

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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) 0.76 2.17 -13.13 2 5 0 78 251.311 4 ↓

Analogs

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Popular Name: 4-(2-pyrazol-1-ylethylsulfonyl)aniline 4-(2-pyrazol-1-ylethylsulfonyl)a…

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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) -0.04 1.79 -13.22 2 5 0 78 251.311 4 ↓

Analogs

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Popular Name: 3,5-difluoro-4-(2-pyrazol-1-ylethylsulfonyl)aniline 3,5-difluoro-4-(2-pyrazol-1-ylet…

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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) 0.58 2.07 -14.78 2 5 0 78 287.291 4 ↓

Parameters Provided:

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iosrct = affiliate
iid = 191540506

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