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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

Draw Identity 99% 90% 80% 70%

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) 1.04 3.78 -8.11 1 5 0 68 203.201 3 ↓

Analogs

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Popular Name: 2-[2-(3-pyridyl)-1H-imidazol-4-yl]ethanamine 2-[2-(3-pyridyl)-1H-imidazol-4-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) 0.19 1.94 -46.69 4 4 1 69 189.242 3 ↓
Lo Low (pH 4.5-6) 0.19 2.35 -103.21 5 4 2 70 190.25 3 ↓

Analogs

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Popular Name: [2-(3-pyridyl)-1H-imidazol-4-yl]methanamine [2-(3-pyridyl)-1H-imidazol-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) 0.39 1.2 -45.96 4 4 1 69 175.215 2 ↓
Hi High (pH 8-9.5) 0.39 0.77 -7.39 3 4 0 68 174.207 2 ↓

Analogs

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Popular Name: N-methyl-1-[2-(3-pyridyl)-1H-imidazol-4-yl]methanamine N-methyl-1-[2-(3-pyridyl)-1H-imi…

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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 3.07 -40.94 3 4 1 58 189.242 3 ↓
Hi High (pH 8-9.5) 0.77 1.62 -7.51 2 4 0 54 188.234 3 ↓

Analogs

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Popular Name: N-[[2-(3-pyridyl)-1H-imidazol-4-yl]methyl]ethanamine N-[[2-(3-pyridyl)-1H-imidazol-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) 1.15 3.93 -40.19 3 4 1 58 203.269 4 ↓
Hi High (pH 8-9.5) 1.15 2.55 -7.29 2 4 0 54 202.261 4 ↓

Analogs

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Popular Name: N-[[2-(3-pyridyl)-1H-imidazol-4-yl]methyl]propan-1-amine N-[[2-(3-pyridyl)-1H-imidazol-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) 1.65 4.68 -40.99 3 4 1 58 217.296 5 ↓
Hi High (pH 8-9.5) 1.65 3.32 -7.19 2 4 0 54 216.288 5 ↓

Analogs

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Popular Name: N-[[2-(3-pyridyl)-1H-imidazol-4-yl]methyl]propan-2-amine N-[[2-(3-pyridyl)-1H-imidazol-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) 1.44 4.45 -38.47 3 4 1 58 217.296 4 ↓
Hi High (pH 8-9.5) 1.44 3.25 -7.1 2 4 0 54 216.288 4 ↓

Analogs

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Popular Name: 2-methyl-N-[[2-(3-pyridyl)-1H-imidazol-4-yl]methyl]propan-2-amine 2-methyl-N-[[2-(3-pyridyl)-1H-im…

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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 4.88 -37.18 3 4 1 58 231.323 4 ↓
Hi High (pH 8-9.5) 1.95 3.63 -6.95 2 4 0 54 230.315 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-methyl-N-[[2-(3-pyridyl)-1H-imidazol-4-yl]methyl]propan-1-amine 2-methyl-N-[[2-(3-pyridyl)-1H-im…

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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) 1.89 5.38 -41.15 3 4 1 58 231.323 5 ↓
Hi High (pH 8-9.5) 1.89 4 -7.12 2 4 0 54 230.315 5 ↓

Analogs

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Popular Name: 2-methoxy-N-[[2-(3-pyridyl)-1H-imidazol-4-yl]methyl]ethanamine 2-methoxy-N-[[2-(3-pyridyl)-1H-i…

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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) 0.75 3.07 -41.48 3 5 1 67 233.295 6 ↓
Hi High (pH 8-9.5) 0.75 1.7 -9.02 2 5 0 63 232.287 6 ↓

Analogs

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Popular Name: 5-(1-propylimidazol-2-yl)pyridine-2-carboxylic 5-(1-propylimidazol-2-yl)pyridin…

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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) 1.56 6.62 -52 0 5 -1 71 230.247 4 ↓
Mid Mid (pH 6-8) 1.56 7.26 -63.74 1 5 0 72 231.255 4 ↓

Analogs

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Popular Name: 5-(1-propylimidazol-2-yl)pyridine-3-carboxylic 5-(1-propylimidazol-2-yl)pyridin…

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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) 1.47 6.68 -45.05 0 5 -1 71 230.247 4 ↓
Mid Mid (pH 6-8) 1.47 7.26 -54.15 1 5 0 72 231.255 4 ↓

Analogs

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Popular Name: 3-(1-methylimidazol-2-yl)pyridin-4-amine 3-(1-methylimidazol-2-yl)pyridin…

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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) 0.45 3.22 -35.84 3 4 1 58 175.215 1 ↓
Hi High (pH 8-9.5) 0.45 2.76 -7.97 2 4 0 57 174.207 1 ↓
Lo Low (pH 4.5-6) 0.45 3.69 -85.86 4 4 2 59 176.223 1 ↓

Analogs

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Popular Name: 3-(1-propylimidazol-2-yl)pyridin-4-amine 3-(1-propylimidazol-2-yl)pyridin…

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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) 1.33 4.77 -35.31 3 4 1 58 203.269 3 ↓
Hi High (pH 8-9.5) 1.33 4.31 -7.29 2 4 0 57 202.261 3 ↓
Lo Low (pH 4.5-6) 1.33 5.22 -86.2 4 4 2 59 204.277 3 ↓

Analogs

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Popular Name: 3-(1-ethylimidazol-2-yl)pyridin-4-amine 3-(1-ethylimidazol-2-yl)pyridin-…

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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 4.02 -35.47 3 4 1 58 189.242 2 ↓
Hi High (pH 8-9.5) 0.83 3.57 -7.64 2 4 0 57 188.234 2 ↓
Lo Low (pH 4.5-6) 0.83 4.47 -85.55 4 4 2 59 190.25 2 ↓

Analogs

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Popular Name: 3-(1-ethylimidazol-2-yl)pyridin-2-amine 3-(1-ethylimidazol-2-yl)pyridin-…

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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) 1.02 4.5 -8.54 2 4 0 57 188.234 2 ↓
Mid Mid (pH 6-8) 1.02 4.97 -29.15 3 4 1 58 189.242 2 ↓

Analogs

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Popular Name: 3-(1-propylimidazol-2-yl)pyridin-2-amine 3-(1-propylimidazol-2-yl)pyridin…

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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) 1.52 5.24 -8.23 2 4 0 57 202.261 3 ↓
Mid Mid (pH 6-8) 1.52 5.72 -29.17 3 4 1 58 203.269 3 ↓

Analogs

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Popular Name: 3-(1-methylimidazol-2-yl)pyridin-2-amine 3-(1-methylimidazol-2-yl)pyridin…

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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) 0.65 3.74 -8.86 2 4 0 57 174.207 1 ↓
Mid Mid (pH 6-8) 0.65 4.18 -29.67 3 4 1 58 175.215 1 ↓

Analogs

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Popular Name: 4-methyl-3-(1-propylimidazol-2-yl)pyridin-2-amine 4-methyl-3-(1-propylimidazol-2-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) 1.90 5.79 -7.73 2 4 0 57 216.288 3 ↓
Mid Mid (pH 6-8) 1.90 6.25 -35 3 4 1 58 217.296 3 ↓
Mid Mid (pH 6-8) 1.90 6.23 -28.65 3 4 1 58 217.296 3 ↓

Analogs

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Popular Name: 3-(1-ethylimidazol-2-yl)-4-methyl-pyridin-2-amine 3-(1-ethylimidazol-2-yl)-4-methy…

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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 5.05 -7.92 2 4 0 57 202.261 2 ↓
Mid Mid (pH 6-8) 1.40 5.52 -35.13 3 4 1 58 203.269 2 ↓
Mid Mid (pH 6-8) 1.40 5.49 -28.57 3 4 1 58 203.269 2 ↓

Analogs

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Popular Name: 4-methyl-3-(1-methylimidazol-2-yl)pyridin-2-amine 4-methyl-3-(1-methylimidazol-2-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) 1.02 3.99 -8.34 2 4 0 57 188.234 1 ↓
Mid Mid (pH 6-8) 1.02 4.46 -29.26 3 4 1 58 189.242 1 ↓
Mid Mid (pH 6-8) 1.02 4.47 -35.6 3 4 1 58 189.242 1 ↓

Analogs

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Popular Name: 5-methyl-3-(1-propylimidazol-2-yl)pyridin-2-amine 5-methyl-3-(1-propylimidazol-2-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) 1.95 5.88 -8 2 4 0 57 216.288 3 ↓
Mid Mid (pH 6-8) 1.95 6.34 -28.96 3 4 1 58 217.296 3 ↓

Analogs

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Popular Name: 3-(1-ethylimidazol-2-yl)-5-methyl-pyridin-2-amine 3-(1-ethylimidazol-2-yl)-5-methy…

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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) 1.45 5.13 -8.32 2 4 0 57 202.261 2 ↓
Mid Mid (pH 6-8) 1.45 5.61 -28.96 3 4 1 58 203.269 2 ↓

Analogs

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Popular Name: 5-methyl-3-(1-methylimidazol-2-yl)pyridin-2-amine 5-methyl-3-(1-methylimidazol-2-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) 1.07 4.34 -8.58 2 4 0 57 188.234 1 ↓
Mid Mid (pH 6-8) 1.07 4.77 -29.42 3 4 1 58 189.242 1 ↓

Analogs

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Popular Name: 5-chloro-3-(1-propylimidazol-2-yl)pyridin-2-amine 5-chloro-3-(1-propylimidazol-2-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) 2.35 5.74 -6.14 2 4 0 57 236.706 3 ↓
Mid Mid (pH 6-8) 2.35 6.22 -30.28 3 4 1 58 237.714 3 ↓

Analogs

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Popular Name: 5-chloro-3-(1-ethylimidazol-2-yl)pyridin-2-amine 5-chloro-3-(1-ethylimidazol-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) 1.85 4.99 -6.47 2 4 0 57 222.679 2 ↓
Mid Mid (pH 6-8) 1.85 5.47 -30.13 3 4 1 58 223.687 2 ↓

Analogs

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Popular Name: 5-chloro-3-(1-methylimidazol-2-yl)pyridin-2-amine 5-chloro-3-(1-methylimidazol-2-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) 1.47 4.22 -6.77 2 4 0 57 208.652 1 ↓
Mid Mid (pH 6-8) 1.47 4.67 -30.66 3 4 1 58 209.66 1 ↓

Analogs

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Popular Name: 1-[2-(3-pyridyl)-1H-imidazol-4-yl]ethanone 1-[2-(3-pyridyl)-1H-imidazol-4-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) 1.11 3.62 -9.98 1 4 0 59 187.202 2 ↓

Analogs

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Popular Name: 3-[1-(3-ethoxypropyl)imidazol-2-yl]pyridine 3-[1-(3-ethoxypropyl)imidazol-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) 1.67 6.16 -10.97 0 4 0 40 231.299 6 ↓
Mid Mid (pH 6-8) 1.67 6.74 -32.77 1 4 1 41 232.307 6 ↓

Analogs

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Popular Name: N,N-diethyl-2-[2-(3-pyridyl)imidazol-1-yl]ethanamine N,N-diethyl-2-[2-(3-pyridyl)imid…

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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) 1.82 7.88 -50.67 1 4 1 35 245.35 6 ↓
Hi High (pH 8-9.5) 1.82 5.78 -8.24 0 4 0 34 244.342 6 ↓
Lo Low (pH 4.5-6) 1.82 8.57 -94.39 2 4 2 36 246.358 6 ↓

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