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Analogs

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Popular Name: 2-cyclopropyl-1-(2-methylsulfonylethyl)benzimidazol-5-amine 2-cyclopropyl-1-(2-methylsulfony…

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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) 0.40 3.48 -17.29 2 5 0 78 279.365 4 ↓
Mid Mid (pH 6-8) 0.40 3.85 -34.12 3 5 1 79 280.373 4 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-(2-ethoxyethyl)benzimidazol-5-amine 2-cyclopropyl-1-(2-ethoxyethyl)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) 1.36 5.96 -8.76 2 4 0 53 245.326 5 ↓
Mid Mid (pH 6-8) 1.36 6.33 -23.62 3 4 1 54 246.334 5 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-(2,2,2-trifluoroethyl)benzimidazol-5-amine 2-cyclopropyl-1-(2,2,2-trifluoro…

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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) 1.93 6.29 -10.42 2 3 0 44 255.243 3 ↓
Mid Mid (pH 6-8) 1.93 6.66 -27 3 3 1 45 256.251 3 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-[(1R)-1-methylpropyl]benzimidazol-5-amine 2-cyclopropyl-1-[(1R)-1-methylpr…

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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 6.89 -9.16 2 3 0 44 229.327 3 ↓
Mid Mid (pH 6-8) 2.24 7.25 -22.08 3 3 1 45 230.335 3 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-[(1S)-1-methylpropyl]benzimidazol-5-amine 2-cyclopropyl-1-[(1S)-1-methylpr…

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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 6.89 -9.14 2 3 0 44 229.327 3 ↓
Mid Mid (pH 6-8) 2.24 7.25 -22.07 3 3 1 45 230.335 3 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-ethyl-benzimidazol-5-amine 2-cyclopropyl-1-ethyl-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) 1.38 5.95 -9.87 2 3 0 44 201.273 2 ↓
Mid Mid (pH 6-8) 1.38 6.32 -22.9 3 3 1 45 202.281 2 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-isobutyl-benzimidazol-5-amine 2-cyclopropyl-1-isobutyl-benzimi…

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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) 2.12 7.11 -9.22 2 3 0 44 229.327 3 ↓
Mid Mid (pH 6-8) 2.12 7.18 -22.72 3 3 1 45 230.335 3 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-(1-ethylpropyl)benzimidazol-5-amine 2-cyclopropyl-1-(1-ethylpropyl)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) 2.75 7.83 -9.11 2 3 0 44 243.354 4 ↓
Mid Mid (pH 6-8) 2.75 8.19 -21.96 3 3 1 45 244.362 4 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-propyl-benzimidazol-5-amine 2-cyclopropyl-1-propyl-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) 1.88 6.71 -9.46 2 3 0 44 215.3 3 ↓
Mid Mid (pH 6-8) 1.88 7.08 -22.75 3 3 1 45 216.308 3 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-(3-ethoxypropyl)benzimidazol-5-amine 2-cyclopropyl-1-(3-ethoxypropyl)…

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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 6.74 -11.12 2 4 0 53 259.353 6 ↓
Mid Mid (pH 6-8) 1.63 7.11 -25.19 3 4 1 54 260.361 6 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-(2-methoxyethyl)benzimidazol-5-amine 2-cyclopropyl-1-(2-methoxyethyl)…

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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) 0.99 5 -8.91 2 4 0 53 231.299 4 ↓
Mid Mid (pH 6-8) 0.99 5.37 -23.67 3 4 1 54 232.307 4 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-(1,1-dimethylpropyl)benzimidazol-5-amine 2-cyclopropyl-1-(1,1-dimethylpro…

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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 7.12 -21.48 3 3 1 45 244.362 3 ↓
Mid Mid (pH 6-8) 2.69 6.76 -9.6 2 3 0 44 243.354 3 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-(2-dimethylaminoethyl)benzimidazol-5-amine 2-cyclopropyl-1-(2-dimethylamino…

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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) 1.03 7.26 -48.91 3 4 1 48 245.35 4 ↓
Hi High (pH 8-9.5) 1.03 4.79 -8.85 2 4 0 47 244.342 4 ↓
Mid Mid (pH 6-8) 1.03 7.63 -88.45 4 4 2 50 246.358 4 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-[3-(dimethylamino)-2,2-dimethyl-propyl]benzimidazol-5-amine 2-cyclopropyl-1-[3-(dimethylamin…

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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) 2.19 8.75 -81.01 4 4 2 50 288.439 5 ↓
Mid Mid (pH 6-8) 2.19 8.35 -47.84 3 4 1 48 287.431 5 ↓

Analogs

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Popular Name: 1-tert-butyl-2-cyclopropyl-benzimidazol-5-amine 1-tert-butyl-2-cyclopropyl-benzi…

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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) 2.19 6.29 -9.87 2 3 0 44 229.327 2 ↓
Mid Mid (pH 6-8) 2.19 6.67 -21.62 3 3 1 45 230.335 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) 0.86 6.2 -14.92 2 5 0 70 245.282 4 ↓
Mid Mid (pH 6-8) 0.86 6.56 -28.18 3 5 1 71 246.29 4 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-[3-(dimethylamino)propyl]benzimidazol-5-amine 2-cyclopropyl-1-[3-(dimethylamin…

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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 8.02 -47.55 3 4 1 48 259.377 5 ↓
Mid Mid (pH 6-8) 1.30 8.38 -82.53 4 4 2 50 260.385 5 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-[3-(diethylamino)propyl]benzimidazol-5-amine 2-cyclopropyl-1-[3-(diethylamino…

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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 9.38 -45.77 3 4 1 48 287.431 7 ↓
Mid Mid (pH 6-8) 2.06 9.76 -82.1 4 4 2 50 288.439 7 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-(2-diethylaminoethyl)benzimidazol-5-amine 2-cyclopropyl-1-(2-diethylaminoe…

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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) 1.78 8.61 -46.69 3 4 1 48 273.404 6 ↓
Hi High (pH 8-9.5) 1.78 6.5 -8.41 2 4 0 47 272.396 6 ↓
Mid Mid (pH 6-8) 1.78 8.98 -87.98 4 4 2 50 274.412 6 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-[(1R)-1,2-dimethylpropyl]benzimidazol-5-amine 2-cyclopropyl-1-[(1R)-1,2-dimeth…

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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) 2.49 7.75 -9.06 2 3 0 44 243.354 3 ↓
Mid Mid (pH 6-8) 2.49 8.11 -22.01 3 3 1 45 244.362 3 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-[(1S)-1,2-dimethylpropyl]benzimidazol-5-amine 2-cyclopropyl-1-[(1S)-1,2-dimeth…

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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) 2.49 7.75 -9.08 2 3 0 44 243.354 3 ↓
Mid Mid (pH 6-8) 2.49 8.11 -21.98 3 3 1 45 244.362 3 ↓

Analogs

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Popular Name: 2-(5-amino-2-cyclopropyl-benzimidazol-1-yl)acetamide 2-(5-amino-2-cyclopropyl-benzimi…

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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) -0.27 2.23 -18.86 4 5 0 87 230.271 3 ↓
Mid Mid (pH 6-8) -0.27 2.59 -30.21 5 5 1 88 231.279 3 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-isopropyl-benzimidazol-5-amine 2-cyclopropyl-1-isopropyl-benzim…

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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 6.26 -9.49 2 3 0 44 215.3 2 ↓
Mid Mid (pH 6-8) 1.74 6.62 -22.29 3 3 1 45 216.308 2 ↓

Analogs

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Popular Name: 1-butyl-2-cyclopropyl-benzimidazol-5-amine 1-butyl-2-cyclopropyl-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) 2.44 7.49 -9.33 2 3 0 44 229.327 4 ↓
Mid Mid (pH 6-8) 2.44 7.86 -23.17 3 3 1 45 230.335 4 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-isopentyl-benzimidazol-5-amine 2-cyclopropyl-1-isopentyl-benzim…

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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) 2.65 8.37 -23.13 3 3 1 45 244.362 4 ↓
Mid Mid (pH 6-8) 2.65 8 -9.1 2 3 0 44 243.354 4 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-pentyl-benzimidazol-5-amine 2-cyclopropyl-1-pentyl-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) 2.94 8.27 -9.27 2 3 0 44 243.354 5 ↓
Mid Mid (pH 6-8) 2.94 8.64 -23.34 3 3 1 45 244.362 5 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-[(1S)-2-methoxy-1-methyl-ethyl]benzimidazol-5-amine 2-cyclopropyl-1-[(1S)-2-methoxy-…

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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) 1.35 5.35 -8.43 2 4 0 53 245.326 4 ↓
Mid Mid (pH 6-8) 1.35 5.71 -22.8 3 4 1 54 246.334 4 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-[(1R)-2-methoxy-1-methyl-ethyl]benzimidazol-5-amine 2-cyclopropyl-1-[(1R)-2-methoxy-…

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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) 1.35 5.35 -8.43 2 4 0 53 245.326 4 ↓
Mid Mid (pH 6-8) 1.35 5.71 -22.83 3 4 1 54 246.334 4 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-[(1R)-1-methylbutyl]benzimidazol-5-amine 2-cyclopropyl-1-[(1R)-1-methylbu…

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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) 2.80 7.65 -9.07 2 3 0 44 243.354 4 ↓
Mid Mid (pH 6-8) 2.80 8.01 -22.42 3 3 1 45 244.362 4 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-[(1S)-1-methylbutyl]benzimidazol-5-amine 2-cyclopropyl-1-[(1S)-1-methylbu…

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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) 2.80 7.65 -9.09 2 3 0 44 243.354 4 ↓
Mid Mid (pH 6-8) 2.80 8.01 -22.46 3 3 1 45 244.362 4 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-(3-methoxypropyl)benzimidazol-5-amine 2-cyclopropyl-1-(3-methoxypropyl…

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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 5.78 -11.22 2 4 0 53 245.326 5 ↓
Mid Mid (pH 6-8) 1.26 6.15 -25.24 3 4 1 54 246.334 5 ↓

Analogs

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Popular Name: 2-(5-amino-2-cyclopropyl-benzimidazol-1-yl)-N-methyl-acetamide 2-(5-amino-2-cyclopropyl-benzimi…

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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) 0.11 3.71 -18.71 3 5 0 73 244.298 3 ↓
Mid Mid (pH 6-8) 0.11 4.07 -29.97 4 5 1 74 245.306 3 ↓

Analogs

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Popular Name: 2-(5-amino-2-cyclopropyl-benzimidazol-1-yl)-N,N-dimethyl-acetamide 2-(5-amino-2-cyclopropyl-benzimi…

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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) -0.09 5.65 -18.44 2 5 0 64 258.325 3 ↓
Mid Mid (pH 6-8) -0.09 5.97 -29.66 3 5 1 65 259.333 3 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-[(1R)-1,3-dimethylbutyl]benzimidazol-5-amine 2-cyclopropyl-1-[(1R)-1,3-dimeth…

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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) 3.02 8.52 -22.38 3 3 1 45 258.389 4 ↓
Mid Mid (pH 6-8) 3.02 8.16 -8.88 2 3 0 44 257.381 4 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-[(1S)-1,3-dimethylbutyl]benzimidazol-5-amine 2-cyclopropyl-1-[(1S)-1,3-dimeth…

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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) 3.02 8.84 -22.39 3 3 1 45 258.389 4 ↓
Mid Mid (pH 6-8) 3.02 8.18 -8.88 2 3 0 44 257.381 4 ↓

Analogs

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Popular Name: 2-(5-amino-2-cyclopropyl-benzimidazol-1-yl)ethanesulfonamide 2-(5-amino-2-cyclopropyl-benzimi…

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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) -0.21 0.94 -17.25 4 6 0 104 280.353 4 ↓
Mid Mid (pH 6-8) -0.21 1.29 -35.31 5 6 1 105 281.361 4 ↓

Analogs

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Popular Name: N-[2-(5-amino-2-cyclopropyl-benzimidazol-1-yl)ethyl]acetamide N-[2-(5-amino-2-cyclopropyl-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) 0.15 4.29 -17.44 3 5 0 73 258.325 4 ↓
Mid Mid (pH 6-8) 0.15 4.67 -32.15 4 5 1 74 259.333 4 ↓

Analogs

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Popular Name: 3-(5-amino-2-cyclopropyl-benzimidazol-1-yl)propanamide 3-(5-amino-2-cyclopropyl-benzimi…

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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 2.76 -12.7 4 5 0 87 244.298 4 ↓
Mid Mid (pH 6-8) 0.00 3.11 -28.41 5 5 1 88 245.306 4 ↓

Analogs

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Popular Name: (2S)-2-(5-amino-2-cyclopropyl-benzimidazol-1-yl)propanamide (2S)-2-(5-amino-2-cyclopropyl-be…

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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) 0.10 2.45 -17.56 4 5 0 87 244.298 3 ↓
Mid Mid (pH 6-8) 0.10 2.81 -29.04 5 5 1 88 245.306 3 ↓

Analogs

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Popular Name: (2R)-2-(5-amino-2-cyclopropyl-benzimidazol-1-yl)propanamide (2R)-2-(5-amino-2-cyclopropyl-be…

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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) 0.10 2.44 -17.29 4 5 0 87 244.298 3 ↓
Mid Mid (pH 6-8) 0.10 2.8 -29.04 5 5 1 88 245.306 3 ↓

Analogs

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Popular Name: N-[2-(5-amino-2-cyclopropyl-benzimidazol-1-yl)ethyl]methanesulfonamide N-[2-(5-amino-2-cyclopropyl-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) 0.16 2.09 -17.57 3 6 0 90 294.38 5 ↓
Mid Mid (pH 6-8) 0.16 2.46 -34.92 4 6 1 91 295.388 5 ↓

Analogs

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Popular Name: 2-(5-amino-2-cyclopropyl-benzimidazol-1-yl)-N-isopropyl-acetamide 2-(5-amino-2-cyclopropyl-benzimi…

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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 5.36 -17.94 3 5 0 73 272.352 4 ↓
Mid Mid (pH 6-8) 0.78 5.72 -29.19 4 5 1 74 273.36 4 ↓

Analogs

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Popular Name: 2-(5-amino-2-cyclopropyl-benzimidazol-1-yl)-N-propyl-acetamide 2-(5-amino-2-cyclopropyl-benzimi…

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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) 0.99 5.31 -18.01 3 5 0 73 272.352 5 ↓
Mid Mid (pH 6-8) 0.99 5.67 -29.6 4 5 1 74 273.36 5 ↓

Analogs

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Popular Name: 2-(5-amino-2-cyclopropyl-benzimidazol-1-yl)-N-ethyl-acetamide 2-(5-amino-2-cyclopropyl-benzimi…

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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) 0.48 4.55 -18.07 3 5 0 73 258.325 4 ↓
Mid Mid (pH 6-8) 0.48 4.91 -29.46 4 5 1 74 259.333 4 ↓

Analogs

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Popular Name: ethyl ethyl

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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) 1.24 7.12 -14.58 2 5 0 70 259.309 5 ↓
Mid Mid (pH 6-8) 1.24 7.48 -27.8 3 5 1 71 260.317 5 ↓

Analogs

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Popular Name: 4-(5-amino-2-cyclopropyl-benzimidazol-1-yl)butanamide 4-(5-amino-2-cyclopropyl-benzimi…

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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) 0.28 3.58 -18.65 4 5 0 87 258.325 5 ↓
Mid Mid (pH 6-8) 0.28 3.92 -31.55 5 5 1 88 259.333 5 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-[(1R)-1-methylpentyl]benzimidazol-5-amine 2-cyclopropyl-1-[(1R)-1-methylpe…

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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) 3.31 8.43 -9 2 3 0 44 257.381 5 ↓
Mid Mid (pH 6-8) 3.31 8.79 -22.57 3 3 1 45 258.389 5 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-[(1S)-1-methylpentyl]benzimidazol-5-amine 2-cyclopropyl-1-[(1S)-1-methylpe…

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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) 3.31 8.43 -9.02 2 3 0 44 257.381 5 ↓
Mid Mid (pH 6-8) 3.31 8.79 -22.6 3 3 1 45 258.389 5 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-[(1R)-1-ethylbutyl]benzimidazol-5-amine 2-cyclopropyl-1-[(1R)-1-ethylbut…

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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) 3.31 8.58 -9 2 3 0 44 257.381 5 ↓
Mid Mid (pH 6-8) 3.31 8.94 -22.27 3 3 1 45 258.389 5 ↓

Analogs

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Popular Name: 2-cyclopropyl-1-[(1S)-1-ethylbutyl]benzimidazol-5-amine 2-cyclopropyl-1-[(1S)-1-ethylbut…

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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) 3.31 8.88 -9.22 2 3 0 44 257.381 5 ↓
Mid Mid (pH 6-8) 3.31 9.24 -22.39 3 3 1 45 258.389 5 ↓

Parameters Provided:

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