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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: 5-[[4-(1,3-benzodioxol-5-ylmethyl)-1-methyl-imidazol-2-yl]amino]-2-imino-3-methyl-imidazol-4-one 5-[[4-(1,3-benzodioxol-5-ylmethy…

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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 10.14 -21.58 2 9 0 110 340.343 3 ↓
Mid Mid (pH 6-8) -3.20 10.63 -40.55 3 9 1 109 341.351 4 ↓

Analogs

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Popular Name: N-(1-methyl-4-oxo-5H-imidazol-2-yl)-6-oxo-1H-pyridine-3-carboxamide N-(1-methyl-4-oxo-5H-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) -0.28 2.13 -39.34 2 7 -1 106 233.207 1 ↓

Analogs

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Popular Name: N-(1-benzylimidazol-2-yl)-2-[methyl(pyrazin-2-yl)amino]acetamide N-(1-benzylimidazol-2-yl)-2-[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) 1.41 9.32 -15.78 1 7 0 79 322.372 5 ↓

Analogs

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Popular Name: N-(1-benzylimidazol-2-yl)-2-ethyl-4-methyl-thiazole-5-carboxamide N-(1-benzylimidazol-2-yl)-2-ethy…

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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 10.1 -14.72 1 5 0 63 326.425 4 ↓

Analogs

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Popular Name: N-(1-benzylimidazol-2-yl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide N-(1-benzylimidazol-2-yl)-2-(2,4…

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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 9.96 -22.28 2 8 0 105 375.388 4 ↓
Hi High (pH 8-9.5) 2.11 8.1 -64.32 1 8 -1 108 374.38 4 ↓

Analogs

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Popular Name: 3-(1,3-dioxoisoindolin-2-yl)-N-(1-isobutylimidazol-2-yl)propanamide 3-(1,3-dioxoisoindolin-2-yl)-N-(…

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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 9.02 -17.73 1 7 0 89 340.383 5 ↓

Analogs

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Popular Name: N-(1H-imidazol-2-yl)piperidine-4-sulfonamide N-(1H-imidazol-2-yl)piperidine-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) -0.52 1.94 -52.3 4 6 1 95 231.301 2 ↓
Hi High (pH 8-9.5) -0.70 1.55 -70.48 3 6 0 94 230.293 3 ↓

Analogs

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Popular Name: tert-butyl tert-butyl

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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) 2.25 3.28 -10.19 2 5 0 70 262.107 2 ↓
Hi High (pH 8-9.5) 1.70 4.85 -46.64 1 5 -1 73 261.099 3 ↓

Analogs

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Popular Name: N-(1H-imidazol-2-yl)-3-[(2S)-tetrahydropyran-2-yl]propanamide N-(1H-imidazol-2-yl)-3-[(2S)-tet…

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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 4.87 -11.64 2 5 0 70 223.276 3 ↓

Analogs

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Popular Name: N-(1H-imidazol-2-yl)-3-[(2R)-tetrahydropyran-2-yl]propanamide N-(1H-imidazol-2-yl)-3-[(2R)-tet…

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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 4.87 -11.62 2 5 0 70 223.276 3 ↓

Analogs

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Popular Name: (2R)-N-(1H-imidazol-2-yl)-2,3-dimethyl-butanamide (2R)-N-(1H-imidazol-2-yl)-2,3-di…

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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) 2.23 4.82 -9.88 2 4 0 61 181.239 2 ↓

Analogs

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Popular Name: (2S)-N-(1H-imidazol-2-yl)-2,3-dimethyl-butanamide (2S)-N-(1H-imidazol-2-yl)-2,3-di…

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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) 2.23 4.82 -9.89 2 4 0 61 181.239 2 ↓

Analogs

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Popular Name: 4,5-dichloro-N-(1-isobutylimidazol-2-yl)-1-methyl-pyrrole-2-carboxamide 4,5-dichloro-N-(1-isobutylimidaz…

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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) 3.13 10.13 -10.74 1 5 0 55 315.204 3 ↓

Analogs

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Popular Name: 4-[[(3-ethylisoxazol-5-yl)methyl-methyl-amino]methyl]-N-(1-methylimidazol-2-yl)benzamide 4-[[(3-ethylisoxazol-5-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) 2.10 8.79 -18.86 1 7 0 79 353.426 6 ↓
Mid Mid (pH 6-8) 2.10 11.14 -57.82 2 7 1 81 354.434 6 ↓

Analogs

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Popular Name: (1R,2R,4S)-N-(1-isobutylimidazol-2-yl)norbornane-2-carboxamide (1R,2R,4S)-N-(1-isobutylimidazol…

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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) 2.71 9.3 -9.99 1 4 0 50 261.369 3 ↓

Analogs

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Popular Name: (1R,2S,4S)-N-(1-isobutylimidazol-2-yl)norbornane-2-carboxamide (1R,2S,4S)-N-(1-isobutylimidazol…

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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) 2.71 9.2 -9.89 1 4 0 50 261.369 3 ↓

Analogs

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Popular Name: N-(1-methylimidazol-2-yl)-4-[(4-pyrimidin-2-yloxy-1-piperidyl)methyl]benzamide N-(1-methylimidazol-2-yl)-4-[(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 8.99 -54.39 2 8 1 90 393.471 5 ↓
Mid Mid (pH 6-8) 0.70 6.74 -19.84 1 8 0 88 392.463 5 ↓

Analogs

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Popular Name: N-(1H-imidazol-2-yl)-2-methyl-2-methylsulfonyl-propanamide N-(1H-imidazol-2-yl)-2-methyl-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) -0.19 1.16 -24.38 2 6 0 95 231.277 2 ↓

Analogs

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Popular Name: N-(1-isobutylimidazol-2-yl)-2-[(1R,2S,4S)-norbornan-2-yl]acetamide N-(1-isobutylimidazol-2-yl)-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) 2.98 10 -9.91 1 4 0 50 275.396 4 ↓

Analogs

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Popular Name: N-(1-isobutylimidazol-2-yl)-2-[(1R,2R,4S)-norbornan-2-yl]acetamide N-(1-isobutylimidazol-2-yl)-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) 2.98 9.95 -9.81 1 4 0 50 275.396 4 ↓

Analogs

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Popular Name: N-(1-benzylimidazol-2-yl)-5-nitro-thiophene-3-carboxamide N-(1-benzylimidazol-2-yl)-5-nitr…

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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 10.75 -15.62 1 7 0 96 328.353 4 ↓

Analogs

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Popular Name: 5-amino-N-(1H-imidazol-2-yl)pentanamide 5-amino-N-(1H-imidazol-2-yl)pent…

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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 1.88 -47.74 5 5 1 89 183.235 4 ↓

Analogs

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Popular Name: (1R,3S)-N-(1-isobutylimidazol-2-yl)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxamide (1R,3S)-N-(1-isobutylimidazol-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) 4.14 11.05 -10.67 1 4 0 50 289.423 4 ↓

Analogs

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Popular Name: (1S,3S)-N-(1-isobutylimidazol-2-yl)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxamide (1S,3S)-N-(1-isobutylimidazol-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) 4.14 10.8 -10.86 1 4 0 50 289.423 4 ↓

Analogs

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Popular Name: (1R,3R)-N-(1-isobutylimidazol-2-yl)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxamide (1R,3R)-N-(1-isobutylimidazol-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) 4.14 10.92 -10.86 1 4 0 50 289.423 4 ↓

Analogs

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Popular Name: (1S,3R)-N-(1-isobutylimidazol-2-yl)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxamide (1S,3R)-N-(1-isobutylimidazol-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) 4.14 10.81 -9.8 1 4 0 50 289.423 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) 2.79 8.4 -20.29 2 7 0 88 330.388 6 ↓

Analogs

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Popular Name: 4-chloro-N-(1-isobutylimidazol-2-yl)-1H-pyrrole-2-carboxamide 4-chloro-N-(1-isobutylimidazol-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) 2.27 7.25 -12.69 2 5 0 66 266.732 3 ↓

Analogs

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Popular Name: (1R,2S)-2-(4-fluorophenyl)-N-(1-isobutylimidazol-2-yl)cyclopropanecarboxamide (1R,2S)-2-(4-fluorophenyl)-N-(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) 3.16 11.1 -10.26 1 4 0 50 301.365 4 ↓

Analogs

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Popular Name: (1S,2S)-2-(4-fluorophenyl)-N-(1-isobutylimidazol-2-yl)cyclopropanecarboxamide (1S,2S)-2-(4-fluorophenyl)-N-(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) 3.16 11.17 -11.66 1 4 0 50 301.365 4 ↓

Analogs

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Popular Name: (1R,2R)-2-(4-fluorophenyl)-N-(1-isobutylimidazol-2-yl)cyclopropanecarboxamide (1R,2R)-2-(4-fluorophenyl)-N-(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) 3.16 11.17 -11.57 1 4 0 50 301.365 4 ↓

Analogs

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Popular Name: N-(1-isobutylimidazol-2-yl)-2-methoxy-acetamide N-(1-isobutylimidazol-2-yl)-2-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) 0.78 5.71 -13.17 1 5 0 59 211.265 4 ↓

Analogs

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Popular Name: N-(1-isobutylimidazol-2-yl)-2-(1-methylindol-3-yl)acetamide N-(1-isobutylimidazol-2-yl)-2-(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) 2.82 11.2 -14.97 1 5 0 55 310.401 4 ↓

Analogs

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Popular Name: (2R)-N-(1H-imidazol-2-yl)-6-azaspiro[2.5]octane-2-carboxamide (2R)-N-(1H-imidazol-2-yl)-6-azas…

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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) 0.12 4.5 -42.68 4 5 1 78 221.284 1 ↓

Analogs

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Popular Name: (2S)-N-(1H-imidazol-2-yl)-6-azaspiro[2.5]octane-2-carboxamide (2S)-N-(1H-imidazol-2-yl)-6-azas…

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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) 0.12 4.5 -42.67 4 5 1 78 221.284 1 ↓

Analogs

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Popular Name: (4S)-4-amino-N-(1H-imidazol-2-yl)pentanamide (4S)-4-amino-N-(1H-imidazol-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) -0.65 1.81 -45.41 5 5 1 89 183.235 3 ↓

Analogs

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Popular Name: (4R)-4-amino-N-(1H-imidazol-2-yl)pentanamide (4R)-4-amino-N-(1H-imidazol-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) -0.65 1.81 -45.4 5 5 1 89 183.235 3 ↓

Analogs

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Popular Name: N-(1H-imidazol-2-yl)-1H-imidazole-4-sulfonamide N-(1H-imidazol-2-yl)-1H-imidazol…

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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) -0.53 1.87 -42.55 4 7 1 108 214.23 2 ↓
Mid Mid (pH 6-8) -0.53 1.37 -22.46 3 7 0 107 213.222 2 ↓

Analogs

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Popular Name: N-(1H-imidazol-2-yl)-2-methyl-1H-imidazole-5-sulfonamide N-(1H-imidazol-2-yl)-2-methyl-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) -0.45 1.68 -37.64 4 7 1 108 228.257 2 ↓
Hi High (pH 8-9.5) -0.45 1.21 -21.57 3 7 0 107 227.249 2 ↓

Analogs

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Popular Name: 2-ethyl-N-(1H-imidazol-2-yl)-1H-imidazole-5-sulfonamide 2-ethyl-N-(1H-imidazol-2-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) 0.13 2.29 -36.32 4 7 1 108 242.284 3 ↓
Hi High (pH 8-9.5) 0.13 1.84 -21.33 3 7 0 107 241.276 3 ↓

Analogs

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Popular Name: (2S)-N-(1H-imidazol-2-yl)tetrahydrothiophene-2-carboxamide (2S)-N-(1H-imidazol-2-yl)tetrahy…

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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) 0.52 4.59 -12.79 2 4 0 61 197.263 1 ↓

Analogs

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Popular Name: (2R)-N-(1H-imidazol-2-yl)tetrahydrothiophene-2-carboxamide (2R)-N-(1H-imidazol-2-yl)tetrahy…

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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) 0.52 4.62 -12.93 2 4 0 61 197.263 1 ↓

Analogs

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Popular Name: (3S)-N-(1H-imidazol-2-yl)tetrahydrothiophene-3-carboxamide (3S)-N-(1H-imidazol-2-yl)tetrahy…

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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) 0.63 4.56 -11.38 2 4 0 61 197.263 1 ↓

Analogs

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Popular Name: (3R)-N-(1H-imidazol-2-yl)tetrahydrothiophene-3-carboxamide (3R)-N-(1H-imidazol-2-yl)tetrahy…

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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) 0.63 4.54 -10.8 2 4 0 61 197.263 1 ↓

Analogs

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Popular Name: N-(1H-imidazol-2-yl)-2-methylsulfonyl-acetamide N-(1H-imidazol-2-yl)-2-methylsul…

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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) -1.00 -0.01 -24.23 2 6 0 95 203.223 2 ↓

Analogs

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Popular Name: 2-chloro-N-(1H-imidazol-2-yl)-4-nitro-benzamide 2-chloro-N-(1H-imidazol-2-yl)-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) 1.88 6.67 -11.82 2 7 0 107 266.644 2 ↓

Analogs

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Popular Name: 3-[[3-furylmethyl(methyl)amino]methyl]-N-(1-methylimidazol-2-yl)benzamide 3-[[3-furylmethyl(methyl)amino]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) 1.51 10.58 -45.2 2 6 1 68 325.392 5 ↓
Mid Mid (pH 6-8) 1.51 8.25 -15.65 1 6 0 67 324.384 5 ↓

Analogs

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Popular Name: N-(1H-imidazol-2-yl)-6-nitro-pyridine-3-sulfonamide N-(1H-imidazol-2-yl)-6-nitro-pyr…

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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 3.88 -16.38 2 9 0 137 269.242 3 ↓
Hi High (pH 8-9.5) 0.24 3.56 -40.29 1 9 -1 136 268.234 4 ↓

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) 1.23 5.4 -20.42 2 7 0 104 295.32 5 ↓
Hi High (pH 8-9.5) 1.05 5.09 -55.79 1 7 -1 103 294.312 6 ↓

Analogs

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Popular Name: 3-[[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl-methyl-amino]methyl]-N-(1-methylimidazol-2-yl)benzamide 3-[[(5-ethyl-1,3,4-oxadiazol-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) 0.17 6.53 -50.55 2 8 1 94 355.422 6 ↓
Mid Mid (pH 6-8) 0.17 4.17 -19.53 1 8 0 92 354.414 6 ↓

Parameters Provided:

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Structural Results Found: (before additional filtering)

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