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Analogs

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Popular Name: 3-[2-(1-methyl-1H-pyrazol-4-yl)-1H-1,3-benzodiazol-1-yl]propanoic acid 3-[2-(1-methyl-1H-pyrazol-4-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) 1.51 7.62 -49.83 0 6 -1 76 269.284 4 ↓
Lo Low (pH 4.5-6) 1.51 8.06 -48.52 1 6 0 77 270.292 4 ↓

Analogs

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Popular Name: 1-methyl-2-(1-methylpyrazol-4-yl)benzimidazole-5-carboxylic 1-methyl-2-(1-methylpyrazol-4-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) 1.88 6.71 -57.66 0 6 -1 76 255.257 2 ↓
Lo Low (pH 4.5-6) 1.88 7.22 -52.4 1 6 0 77 256.265 2 ↓

Analogs

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Popular Name: 1-methyl-2-(1,3,5-trimethylpyrazol-4-yl)benzimidazole-5-carboxylic 1-methyl-2-(1,3,5-trimethylpyraz…

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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) 2.32 7.66 -60.34 0 6 -1 76 283.311 2 ↓
Lo Low (pH 4.5-6) 2.32 8.09 -50.47 1 6 0 77 284.319 2 ↓

Analogs

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Popular Name: 2-(1,5-dimethylpyrazol-4-yl)-1-methyl-benzimidazole-5-carboxylic 2-(1,5-dimethylpyrazol-4-yl)-1-m…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.10 7.46 -57.11 0 6 -1 76 269.284 2 ↓
Lo Low (pH 4.5-6) 2.10 7.87 -49.88 1 6 0 77 270.292 2 ↓

Analogs

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Popular Name: 1-methyl-2-(1H-pyrazol-4-yl)benzimidazole-5-carboxylic 1-methyl-2-(1H-pyrazol-4-yl)benz…

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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) 1.81 5.4 -57.06 1 6 -1 87 241.23 2 ↓
Lo Low (pH 4.5-6) 1.81 5.87 -53.23 2 6 0 88 242.238 2 ↓

Analogs

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Popular Name: 2-(1H-pyrazol-4-yl)-1H-benzimidazol-5-amine 2-(1H-pyrazol-4-yl)-1H-benzimida…

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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) 0.91 1.37 -10.02 4 5 0 83 199.217 1 ↓
Lo Low (pH 4.5-6) 0.91 1.8 -30.22 5 5 1 85 200.225 1 ↓

Analogs

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Popular Name: 1H-Benzimidazole, 2-(1H-pyrazol-4-yl)- (9CI) 1H-Benzimidazole, 2-(1H-pyrazol-…

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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) 1.86 3.5 -9.6 2 4 0 57 184.202 1 ↓
Lo Low (pH 4.5-6) 1.86 3.95 -30.36 3 4 1 59 185.21 1 ↓

Analogs

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Popular Name: 6-methyl-2-(1H-pyrazol-4-yl)-1H-benzimidazole 6-methyl-2-(1H-pyrazol-4-yl)-1H-…

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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) 2.28 4.17 -9.41 2 4 0 57 198.229 1 ↓
Lo Low (pH 4.5-6) 2.28 4.6 -30.35 3 4 1 59 199.237 1 ↓

Analogs

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Popular Name: 5,6-dimethoxy-2-(1H-pyrazol-4-yl)-1H-benzimidazole 5,6-dimethoxy-2-(1H-pyrazol-4-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) 1.48 2.71 -11.85 2 6 0 76 244.254 3 ↓
Lo Low (pH 4.5-6) 1.48 3.14 -35.19 3 6 1 77 245.262 3 ↓

Analogs

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Popular Name: 6-methylsulfonyl-2-(1H-pyrazol-4-yl)-1H-benzimidazole 6-methylsulfonyl-2-(1H-pyrazol-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) 0.70 1.04 -16.7 2 6 0 92 262.294 2 ↓

Analogs

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Popular Name: 5,6-dimethyl-2-(1H-pyrazol-4-yl)-1H-benzimidazole 5,6-dimethyl-2-(1H-pyrazol-4-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) 2.66 4.73 -9.66 2 4 0 57 212.256 1 ↓
Lo Low (pH 4.5-6) 2.66 5.15 -29.99 3 4 1 59 213.264 1 ↓

Analogs

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Popular Name: 5,6-difluoro-2-(1H-pyrazol-4-yl)-1H-benzimidazole 5,6-difluoro-2-(1H-pyrazol-4-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) 2.09 3.62 -8.96 2 4 0 57 220.182 1 ↓

Analogs

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Popular Name: 2-[2-(1H-pyrazol-4-yl)benzimidazol-1-yl]acetic 2-[2-(1H-pyrazol-4-yl)benzimidaz…

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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) 1.17 5.89 -51.76 1 6 -1 87 241.23 3 ↓
Lo Low (pH 4.5-6) 1.17 6.4 -40.43 2 6 0 88 242.238 3 ↓

Analogs

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Popular Name: 3-[2-(1H-pyrazol-4-yl)benzimidazol-1-yl]propanoic 3-[2-(1H-pyrazol-4-yl)benzimidaz…

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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 6.31 -48.09 1 6 -1 87 255.257 4 ↓
Lo Low (pH 4.5-6) 1.44 6.9 -47.47 2 6 0 88 256.265 4 ↓

Analogs

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Popular Name: 2-[5,6-dimethyl-2-(1H-pyrazol-4-yl)benzimidazol-1-yl]acetic 2-[5,6-dimethyl-2-(1H-pyrazol-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) 1.97 7.13 -52.8 1 6 -1 87 269.284 3 ↓
Mid Mid (pH 6-8) 1.97 7.58 -41.9 2 6 0 88 270.292 3 ↓

Analogs

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Popular Name: 3-[5,6-dimethyl-2-(1H-pyrazol-4-yl)benzimidazol-1-yl]propanoic 3-[5,6-dimethyl-2-(1H-pyrazol-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) 2.24 7.53 -48.72 1 6 -1 87 283.311 4 ↓
Mid Mid (pH 6-8) 2.24 7.98 -47.48 2 6 0 88 284.319 4 ↓

Analogs

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Popular Name: 2-[5,6-difluoro-2-(1H-pyrazol-4-yl)benzimidazol-1-yl]acetic 2-[5,6-difluoro-2-(1H-pyrazol-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) 1.40 6.02 -45.4 1 6 -1 87 277.21 3 ↓
Lo Low (pH 4.5-6) 1.40 6.47 -43.31 2 6 0 88 278.218 3 ↓

Analogs

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Popular Name: 3-[5,6-difluoro-2-(1H-pyrazol-4-yl)benzimidazol-1-yl]propanoic 3-[5,6-difluoro-2-(1H-pyrazol-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) 1.67 6.43 -43.68 1 6 -1 87 291.237 4 ↓
Lo Low (pH 4.5-6) 1.67 6.87 -51.13 2 6 0 88 292.245 4 ↓

Analogs

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Popular Name: 2-(1H-pyrazol-4-yl)-1H-benzimidazole-5-carboxylic 2-(1H-pyrazol-4-yl)-1H-benzimida…

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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) 1.74 4.04 -51.2 2 6 -1 97 227.203 2 ↓
Lo Low (pH 4.5-6) 1.74 4.48 -57.85 3 6 0 99 228.211 2 ↓

Analogs

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Popular Name: 2-(1H-pyrazol-4-yl)-1H-benzimidazole-4-carboxylic 2-(1H-pyrazol-4-yl)-1H-benzimida…

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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) 1.38 4.15 -50.77 2 6 -1 97 227.203 2 ↓
Lo Low (pH 4.5-6) 1.38 4.58 -50.77 3 6 0 99 228.211 2 ↓

Analogs

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Popular Name: methyl 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) 3.17 7.93 -15.65 1 6 0 73 298.346 5 ↓
Lo Low (pH 4.5-6) 3.17 8.07 -34.96 2 6 1 74 299.354 5 ↓

Analogs

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Popular Name: 6-fluoro-2-(1-methylpyrazol-4-yl)-1H-benzimidazole 6-fluoro-2-(1-methylpyrazol-4-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) 2.06 4.87 -9 1 4 0 47 216.219 1 ↓
Lo Low (pH 4.5-6) 2.06 5.31 -32.76 2 4 1 48 217.227 1 ↓

Analogs

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Popular Name: 2-methyl-4-(6-methyl-1H-benzimidazol-2-yl)pyrazol-3-amine 2-methyl-4-(6-methyl-1H-benzimid…

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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) 1.95 4.73 -9.74 3 5 0 73 227.271 1 ↓

Analogs

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Popular Name: 2-methyl-4-(1-propylbenzimidazol-2-yl)pyrazol-3-amine 2-methyl-4-(1-propylbenzimidazol…

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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) 2.48 6.76 -10.14 2 5 0 62 255.325 3 ↓
Mid Mid (pH 6-8) 2.48 6.91 -37.26 3 5 1 63 256.333 3 ↓
Lo Low (pH 4.5-6) 2.48 7.15 -25.36 3 5 1 63 256.333 3 ↓

Analogs

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Popular Name: 4-(1-isopropylbenzimidazol-2-yl)-2-methyl-pyrazol-3-amine 4-(1-isopropylbenzimidazol-2-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) 2.34 6.34 -10.14 2 5 0 62 255.325 2 ↓
Mid Mid (pH 6-8) 2.34 6.5 -36.86 3 5 1 63 256.333 2 ↓
Lo Low (pH 4.5-6) 2.34 6.74 -24.68 3 5 1 63 256.333 2 ↓

Analogs

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Popular Name: 4-(1-tert-butylbenzimidazol-2-yl)-2-methyl-pyrazol-3-amine 4-(1-tert-butylbenzimidazol-2-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) 2.78 6.28 -10.71 2 5 0 62 269.352 2 ↓
Mid Mid (pH 6-8) 2.78 6.44 -36.14 3 5 1 63 270.36 2 ↓
Lo Low (pH 4.5-6) 2.78 6.71 -23.58 3 5 1 63 270.36 2 ↓

Analogs

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Popular Name: 5,6-dichloro-2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)-1H-benzimidazole 5,6-dichloro-2-(1-ethyl-3,5-dime…

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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) 4.00 8.16 -8.04 1 4 0 47 309.2 2 ↓

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