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

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Popular Name: 1-[3-(imidazol-1-ylmethyl)-2-furyl]-N-methyl-methanamine 1-[3-(imidazol-1-ylmethyl)-2-fur…

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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) 0.33 6.1 -95.28 3 4 2 49 193.25 4 ↓
Mid Mid (pH 6-8) 0.33 5.59 -49.99 2 4 1 48 192.242 4 ↓

Analogs

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Popular Name: N-[[3-(imidazol-1-ylmethyl)-2-furyl]methyl]ethanamine N-[[3-(imidazol-1-ylmethyl)-2-fu…

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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) 0.71 6.96 -95.32 3 4 2 49 207.277 5 ↓
Mid Mid (pH 6-8) 0.71 6.45 -48.89 2 4 1 48 206.269 5 ↓

Analogs

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Popular Name: N-[[3-(imidazol-1-ylmethyl)-2-furyl]methyl]propan-1-amine N-[[3-(imidazol-1-ylmethyl)-2-fu…

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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) 1.21 7.72 -96.9 3 4 2 49 221.304 6 ↓
Mid Mid (pH 6-8) 1.21 7.2 -49.76 2 4 1 48 220.296 6 ↓

Analogs

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Popular Name: N-[[3-(imidazol-1-ylmethyl)-2-furyl]methyl]propan-2-amine N-[[3-(imidazol-1-ylmethyl)-2-fu…

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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) 1.01 7.48 -93.05 3 4 2 49 221.304 5 ↓
Mid Mid (pH 6-8) 1.01 6.98 -47.17 2 4 1 48 220.296 5 ↓

Analogs

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Popular Name: [3-(imidazol-1-ylmethyl)-2-furyl]methanamine [3-(imidazol-1-ylmethyl)-2-furyl…

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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 4.23 -100.9 4 4 2 60 179.223 3 ↓
Mid Mid (pH 6-8) -0.04 3.72 -56.11 3 4 1 59 178.215 3 ↓

Analogs

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Popular Name: [4-(imidazol-1-ylmethyl)-5-methyl-2-furyl]methanamine [4-(imidazol-1-ylmethyl)-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) 0.18 5.15 -92.53 4 4 2 60 193.25 3 ↓
Mid Mid (pH 6-8) 0.18 4.64 -48.97 3 4 1 59 192.242 3 ↓

Analogs

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Popular Name: 1-[4-(imidazol-1-ylmethyl)-5-methyl-2-furyl]-N-methyl-methanamine 1-[4-(imidazol-1-ylmethyl)-5-met…

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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) 0.56 7.02 -87.55 3 4 2 49 207.277 4 ↓
Mid Mid (pH 6-8) 0.56 6.51 -43.65 2 4 1 48 206.269 4 ↓

Analogs

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Popular Name: N-[[4-(imidazol-1-ylmethyl)-5-methyl-2-furyl]methyl]ethanamine N-[[4-(imidazol-1-ylmethyl)-5-me…

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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) 0.93 7.81 -87.24 3 4 2 49 221.304 5 ↓
Mid Mid (pH 6-8) 0.93 7.3 -42.94 2 4 1 48 220.296 5 ↓

Analogs

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Popular Name: N-[[4-(imidazol-1-ylmethyl)-5-methyl-2-furyl]methyl]propan-1-amine N-[[4-(imidazol-1-ylmethyl)-5-me…

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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) 1.43 8.56 -88.66 3 4 2 49 235.331 6 ↓
Mid Mid (pH 6-8) 1.43 8.05 -43.75 2 4 1 48 234.323 6 ↓

Analogs

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Popular Name: N-[[4-(imidazol-1-ylmethyl)-5-methyl-2-furyl]methyl]propan-2-amine N-[[4-(imidazol-1-ylmethyl)-5-me…

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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) 1.23 8.4 -85.78 3 4 2 49 235.331 5 ↓
Mid Mid (pH 6-8) 1.23 7.88 -41.49 2 4 1 48 234.323 5 ↓

Analogs

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Popular Name: N-[[4-(imidazol-1-ylmethyl)-5-methyl-2-furyl]methyl]-2-methyl-propan-2-amine N-[[4-(imidazol-1-ylmethyl)-5-me…

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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 8.81 -84.99 3 4 2 49 249.358 5 ↓
Mid Mid (pH 6-8) 1.74 8.3 -39.49 2 4 1 48 248.35 5 ↓

Analogs

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Popular Name: N-[[4-(imidazol-1-ylmethyl)-5-methyl-2-furyl]methyl]-2-methyl-propan-1-amine N-[[4-(imidazol-1-ylmethyl)-5-me…

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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) 1.68 9.33 -89.13 3 4 2 49 249.358 6 ↓
Mid Mid (pH 6-8) 1.68 8.81 -43.72 2 4 1 48 248.35 6 ↓

Analogs

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Popular Name: N-[[3-(imidazol-1-ylmethyl)-2-furyl]methyl]-2-methyl-propan-1-amine N-[[3-(imidazol-1-ylmethyl)-2-fu…

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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) 1.46 8.41 -97.32 3 4 2 49 235.331 6 ↓
Mid Mid (pH 6-8) 1.46 7.9 -49.55 2 4 1 48 234.323 6 ↓

Analogs

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Popular Name: N-[[3-(imidazol-1-ylmethyl)-2-furyl]methyl]-2-methyl-propan-2-amine N-[[3-(imidazol-1-ylmethyl)-2-fu…

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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 7.9 -91.94 3 4 2 49 235.331 5 ↓
Mid Mid (pH 6-8) 1.52 7.39 -44.54 2 4 1 48 234.323 5 ↓

Analogs

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Popular Name: N-methyl-1-[3-[(2-methylimidazol-1-yl)methyl]-2-furyl]methanamine N-methyl-1-[3-[(2-methylimidazol…

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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) 0.42 5.79 -92.98 3 4 2 49 207.277 4 ↓
Mid Mid (pH 6-8) 0.42 5.32 -50.32 2 4 1 48 206.269 4 ↓

Analogs

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Popular Name: N-[[3-[(2-methylimidazol-1-yl)methyl]-2-furyl]methyl]ethanamine N-[[3-[(2-methylimidazol-1-yl)me…

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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) 0.80 6.64 -92.99 3 4 2 49 221.304 5 ↓
Mid Mid (pH 6-8) 0.80 6.17 -49.14 2 4 1 48 220.296 5 ↓

Analogs

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Popular Name: N-[[3-[(2-methylimidazol-1-yl)methyl]-2-furyl]methyl]propan-1-amine N-[[3-[(2-methylimidazol-1-yl)me…

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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 7.4 -94.55 3 4 2 49 235.331 6 ↓
Mid Mid (pH 6-8) 1.30 6.92 -50.06 2 4 1 48 234.323 6 ↓

Analogs

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Popular Name: N-[[3-[(2-methylimidazol-1-yl)methyl]-2-furyl]methyl]propan-2-amine N-[[3-[(2-methylimidazol-1-yl)me…

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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) 1.09 7.17 -90.63 3 4 2 49 235.331 5 ↓
Mid Mid (pH 6-8) 1.09 6.71 -47.47 2 4 1 48 234.323 5 ↓

Analogs

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Popular Name: [3-[(2-methylimidazol-1-yl)methyl]-2-furyl]methanamine [3-[(2-methylimidazol-1-yl)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) 0.05 3.92 -98.67 4 4 2 60 193.25 3 ↓
Mid Mid (pH 6-8) 0.05 3.45 -56.41 3 4 1 59 192.242 3 ↓

Analogs

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Popular Name: [5-methyl-4-[(2-methylimidazol-1-yl)methyl]-2-furyl]methanamine [5-methyl-4-[(2-methylimidazol-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) 0.27 4.83 -89.9 4 4 2 60 207.277 3 ↓
Mid Mid (pH 6-8) 0.27 4.35 -50.36 3 4 1 59 206.269 3 ↓

Analogs

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Popular Name: N-methyl-1-[5-methyl-4-[(2-methylimidazol-1-yl)methyl]-2-furyl]methanamine N-methyl-1-[5-methyl-4-[(2-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) 0.64 6.7 -84.9 3 4 2 49 221.304 4 ↓
Mid Mid (pH 6-8) 0.64 6.23 -44.93 2 4 1 48 220.296 4 ↓

Analogs

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Popular Name: N-[[5-methyl-4-[(2-methylimidazol-1-yl)methyl]-2-furyl]methyl]ethanamine N-[[5-methyl-4-[(2-methylimidazo…

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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 7.48 -84.57 3 4 2 49 235.331 5 ↓
Mid Mid (pH 6-8) 1.02 7 -44.26 2 4 1 48 234.323 5 ↓

Analogs

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Popular Name: N-[[5-methyl-4-[(2-methylimidazol-1-yl)methyl]-2-furyl]methyl]propan-1-amine N-[[5-methyl-4-[(2-methylimidazo…

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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 8.23 -85.94 3 4 2 49 249.358 6 ↓
Mid Mid (pH 6-8) 1.52 7.76 -45.05 2 4 1 48 248.35 6 ↓

Analogs

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Popular Name: N-[[5-methyl-4-[(2-methylimidazol-1-yl)methyl]-2-furyl]methyl]propan-2-amine N-[[5-methyl-4-[(2-methylimidazo…

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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) 1.31 8.08 -83.08 3 4 2 49 249.358 5 ↓
Mid Mid (pH 6-8) 1.31 7.61 -42.41 2 4 1 48 248.35 5 ↓

Analogs

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Popular Name: 2-methyl-N-[[5-methyl-4-[(2-methylimidazol-1-yl)methyl]-2-furyl]methyl]propan-2-amine 2-methyl-N-[[5-methyl-4-[(2-meth…

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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) 1.83 8.49 -82.24 3 4 2 49 263.385 5 ↓
Mid Mid (pH 6-8) 1.83 8.01 -40.74 2 4 1 48 262.377 5 ↓

Analogs

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Popular Name: 2-methyl-N-[[5-methyl-4-[(2-methylimidazol-1-yl)methyl]-2-furyl]methyl]propan-1-amine 2-methyl-N-[[5-methyl-4-[(2-meth…

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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 9.01 -86.43 3 4 2 49 263.385 6 ↓
Mid Mid (pH 6-8) 1.76 8.53 -45.24 2 4 1 48 262.377 6 ↓

Analogs

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Popular Name: 2-methyl-N-[[3-[(2-methylimidazol-1-yl)methyl]-2-furyl]methyl]propan-1-amine 2-methyl-N-[[3-[(2-methylimidazo…

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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) 1.54 8.1 -95.67 3 4 2 49 249.358 6 ↓
Mid Mid (pH 6-8) 1.54 7.62 -49.85 2 4 1 48 248.35 6 ↓

Analogs

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Popular Name: 2-methyl-N-[[3-[(2-methylimidazol-1-yl)methyl]-2-furyl]methyl]propan-2-amine 2-methyl-N-[[3-[(2-methylimidazo…

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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 7.59 -89.5 3 4 2 49 249.358 5 ↓
Mid Mid (pH 6-8) 1.61 7.12 -44.88 2 4 1 48 248.35 5 ↓

Analogs

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Popular Name: [3-[(2-propylimidazol-1-yl)methyl]-2-furyl]methanamine [3-[(2-propylimidazol-1-yl)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) 1.12 5.14 -99.83 4 4 2 60 221.304 5 ↓
Mid Mid (pH 6-8) 1.12 4.83 -56.4 3 4 1 59 220.296 5 ↓

Analogs

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Popular Name: 3-[(2-ethylimidazol-1-yl)methyl]furan-2-carboxylic 3-[(2-ethylimidazol-1-yl)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) 1.01 7 -46.49 1 5 0 72 220.228 4 ↓
Mid Mid (pH 6-8) 1.01 6.67 -49.81 0 5 -1 71 219.22 4 ↓

Parameters Provided:

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filter.purchasability = annotated
page.format = targets
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Structural Results Found: (before additional filtering)

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SELECT DISTINCT(ci.sub_id_fk) AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id INNER JOIN hasring AS hr ON ci.sub_id_fk=hr.sub_id_fk INNER JOIN rings AS r ON hr.rings_fk=r.rings_id  WHERE r.rings_id = 260458 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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