UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

13209522
13209522
39220634
39220634

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Popular Name: Miroprofen Miroprofen

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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) 3.20 1.66 -55.07 0 4 -1 57 265.292 3 ↓

Analogs

31973141
31973141
31973156
31973156
31973191
31973191
31973205
31973205

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Popular Name: 3-[2-(3-Methoxy-phenyl)-8-methyl-imidazo[1,2-a]-pyridin-3-yl]-acrylic acid 3-[2-(3-Methoxy-phenyl)-8-methyl…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.44 8.95 -52.49 1 5 0 68 308.337 4 ↓

Analogs

31973158
31973158

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Popular Name: 3-(7-Methyl-2-phenyl-imidazo[1,2-a]pyridin-3-yl)-acrylic acid 3-(7-Methyl-2-phenyl-imidazo[1,2…

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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) 3.41 9.7 -53.26 1 4 0 59 278.311 3 ↓

Analogs

31973084
31973084
31973087
31973087
31973104
31973104
31973105
31973105
31973106
31973106

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Popular Name: 3-(2-Phenyl-imidazo[1,2-a]pyridin-3-yl)-acrylicacid 3-(2-Phenyl-imidazo[1,2-a]pyridi…

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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) 3.01 9.04 -55.87 1 4 0 59 264.284 3 ↓

Analogs

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Popular Name: 2-(4-tert-butylphenyl)imidazo[1,2-a]pyridine 2-(4-tert-butylphenyl)imidazo[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) 4.68 10.97 -10.68 0 2 0 17 250.345 2 ↓
Mid Mid (pH 6-8) 4.68 11.41 -26.72 1 2 1 19 251.353 2 ↓

Analogs

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Popular Name: 2-(4-chloro-3-methyl-phenyl)-8-methyl-imidazo[1,2-a]pyridine 2-(4-chloro-3-methyl-phenyl)-8-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) 4.43 10.34 -9.95 0 2 0 17 256.736 1 ↓
Mid Mid (pH 6-8) 4.43 10.8 -28.82 1 2 1 19 257.744 1 ↓

Analogs

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Popular Name: 2-(4-methoxy-3-nitro-phenyl)-8-methyl-imidazo[1,2-a]pyridine 2-(4-methoxy-3-nitro-phenyl)-8-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) 3.32 10.04 -20.1 0 6 0 72 283.287 3 ↓
Lo Low (pH 4.5-6) 3.32 10.48 -38.31 1 6 1 74 284.295 3 ↓

Analogs

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Popular Name: 2-(4-fluoro-3-methyl-phenyl)-8-methyl-imidazo[1,2-a]pyridine 2-(4-fluoro-3-methyl-phenyl)-8-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) 3.91 9.94 -10.34 0 2 0 17 240.281 1 ↓
Mid Mid (pH 6-8) 3.91 10.41 -29.59 1 2 1 19 241.289 1 ↓

Analogs

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Popular Name: 2-(4-fluoro-3-nitro-phenyl)-8-methyl-imidazo[1,2-a]pyridine 2-(4-fluoro-3-nitro-phenyl)-8-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) 3.42 9.98 -17.62 0 5 0 63 271.251 2 ↓
Lo Low (pH 4.5-6) 3.42 10.44 -39.69 1 5 1 64 272.259 2 ↓

Analogs

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Popular Name: 8-methyl-2-(4-methyl-3-nitro-phenyl)imidazo[1,2-a]pyridine 8-methyl-2-(4-methyl-3-nitro-phe…

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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) 3.71 10.56 -17.32 0 5 0 63 267.288 2 ↓
Lo Low (pH 4.5-6) 3.71 11.02 -34.35 1 5 1 64 268.296 2 ↓

Analogs

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Popular Name: 2-(4-chloro-3-methyl-phenyl)-7-methyl-imidazo[1,2-a]pyridine 2-(4-chloro-3-methyl-phenyl)-7-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) 4.43 10.4 -10.05 0 2 0 17 256.736 1 ↓
Mid Mid (pH 6-8) 4.43 10.85 -28.91 1 2 1 19 257.744 1 ↓

Analogs

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Popular Name: 2-(4-methoxy-3-nitro-phenyl)-7-methyl-imidazo[1,2-a]pyridine 2-(4-methoxy-3-nitro-phenyl)-7-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) 3.32 10.1 -20.45 0 6 0 72 283.287 3 ↓
Lo Low (pH 4.5-6) 3.32 10.54 -38.58 1 6 1 74 284.295 3 ↓

Analogs

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Popular Name: 2-(4-fluoro-3-methyl-phenyl)-7-methyl-imidazo[1,2-a]pyridine 2-(4-fluoro-3-methyl-phenyl)-7-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) 3.91 10.01 -10.49 0 2 0 17 240.281 1 ↓
Mid Mid (pH 6-8) 3.91 10.45 -29.73 1 2 1 19 241.289 1 ↓

Analogs

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Popular Name: 2-(4-fluoro-3-nitro-phenyl)-7-methyl-imidazo[1,2-a]pyridine 2-(4-fluoro-3-nitro-phenyl)-7-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) 3.42 10.04 -17.93 0 5 0 63 271.251 2 ↓
Lo Low (pH 4.5-6) 3.42 10.48 -39.99 1 5 1 64 272.259 2 ↓

Analogs

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Popular Name: 7-methyl-2-(4-methyl-3-nitro-phenyl)imidazo[1,2-a]pyridine 7-methyl-2-(4-methyl-3-nitro-phe…

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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) 3.71 10.62 -17.69 0 5 0 63 267.288 2 ↓
Lo Low (pH 4.5-6) 3.71 11.07 -34.58 1 5 1 64 268.296 2 ↓

Analogs

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Popular Name: 2-(2,4-dichlorophenyl)-6-methyl-imidazo[1,2-a]pyridine 2-(2,4-dichlorophenyl)-6-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) 4.66 10.7 -10.02 0 2 0 17 277.154 1 ↓
Mid Mid (pH 6-8) 4.66 10.9 -26.92 1 2 1 19 278.162 1 ↓

Analogs

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Popular Name: 2-(4-tert-butylphenyl)-6-methyl-imidazo[1,2-a]pyridine 2-(4-tert-butylphenyl)-6-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) 5.08 12.06 -25.64 1 2 1 19 265.38 2 ↓
Mid Mid (pH 6-8) 5.08 11.62 -9.91 0 2 0 17 264.372 2 ↓

Analogs

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Popular Name: 2-(3-methoxyphenyl)-6-methyl-imidazo[1,2-a]pyridine 2-(3-methoxyphenyl)-6-methyl-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) 3.41 8.6 -13.24 0 3 0 27 238.29 2 ↓
Mid Mid (pH 6-8) 3.41 9.04 -27.05 1 3 1 28 239.298 2 ↓

Analogs

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Popular Name: 2-(4-methoxy-3-nitro-phenyl)-6-methyl-imidazo[1,2-a]pyridine 2-(4-methoxy-3-nitro-phenyl)-6-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) 3.32 10.1 -19.5 0 6 0 72 283.287 3 ↓
Lo Low (pH 4.5-6) 3.32 10.54 -39.85 1 6 1 74 284.295 3 ↓

Analogs

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Popular Name: 2-(4-fluoro-3-nitro-phenyl)-6-methyl-imidazo[1,2-a]pyridine 2-(4-fluoro-3-nitro-phenyl)-6-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) 3.42 10.04 -16.96 0 5 0 63 271.251 2 ↓
Lo Low (pH 4.5-6) 3.42 10.48 -41.25 1 5 1 64 272.259 2 ↓

Analogs

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Popular Name: 6-methyl-2-(4-methyl-3-nitro-phenyl)imidazo[1,2-a]pyridine 6-methyl-2-(4-methyl-3-nitro-phe…

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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) 3.71 10.62 -16.69 0 5 0 63 267.288 2 ↓
Lo Low (pH 4.5-6) 3.71 11.05 -35.82 1 5 1 64 268.296 2 ↓

Analogs

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Popular Name: 2-(4-methoxy-3-nitro-phenyl)-5-methyl-imidazo[1,2-a]pyridine 2-(4-methoxy-3-nitro-phenyl)-5-m…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.75 9.92 -19.85 0 6 0 72 283.287 3 ↓
Lo Low (pH 4.5-6) 2.75 10.36 -39.18 1 6 1 74 284.295 3 ↓

Analogs

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Popular Name: 2-(4-ethoxy-3-nitro-phenyl)-5-methyl-imidazo[1,2-a]pyridine 2-(4-ethoxy-3-nitro-phenyl)-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) 3.13 10.83 -19.71 0 6 0 72 297.314 4 ↓
Lo Low (pH 4.5-6) 3.13 11.26 -39.27 1 6 1 74 298.322 4 ↓

Analogs

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Popular Name: 2-(4-fluoro-3-nitro-phenyl)-5-methyl-imidazo[1,2-a]pyridine 2-(4-fluoro-3-nitro-phenyl)-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) 2.86 9.86 -17.21 0 5 0 63 271.251 2 ↓
Lo Low (pH 4.5-6) 2.86 10.3 -40.41 1 5 1 64 272.259 2 ↓

Analogs

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Popular Name: 5-methyl-2-(4-methyl-3-nitro-phenyl)imidazo[1,2-a]pyridine 5-methyl-2-(4-methyl-3-nitro-phe…

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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) 3.14 10.45 -17.15 0 5 0 63 267.288 2 ↓
Lo Low (pH 4.5-6) 3.14 10.88 -35.17 1 5 1 64 268.296 2 ↓

Analogs

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Popular Name: 2-(4-chlorophenyl)-6-fluoro-imidazo[1,2-a]pyridine 2-(4-chlorophenyl)-6-fluoro-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) 3.77 9.24 -7.53 0 2 0 17 246.672 1 ↓
Lo Low (pH 4.5-6) 3.77 9.68 -31.75 1 2 1 19 247.68 1 ↓

Analogs

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Popular Name: 6-fluoro-2-(3-nitrophenyl)imidazo[1,2-a]pyridine 6-fluoro-2-(3-nitrophenyl)imidaz…

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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 9.42 -14.8 0 5 0 63 257.224 2 ↓

Analogs

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Popular Name: 2-(4-tert-butylphenyl)-6-fluoro-imidazo[1,2-a]pyridine 2-(4-tert-butylphenyl)-6-fluoro-…

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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) 4.80 11.04 -7.72 0 2 0 17 268.335 2 ↓
Lo Low (pH 4.5-6) 4.80 11.48 -28.32 1 2 1 19 269.343 2 ↓

Analogs

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Popular Name: 6-fluoro-2-(4-methoxyphenyl)imidazo[1,2-a]pyridine 6-fluoro-2-(4-methoxyphenyl)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) 3.15 8.02 -8.79 0 3 0 27 242.253 2 ↓
Mid Mid (pH 6-8) 3.15 8.45 -30.76 1 3 1 28 243.261 2 ↓

Analogs

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Popular Name: 6-fluoro-2-(4-methoxy-3-nitro-phenyl)imidazo[1,2-a]pyridine 6-fluoro-2-(4-methoxy-3-nitro-ph…

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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) 3.03 9.52 -17.78 0 6 0 72 287.25 3 ↓

Analogs

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Popular Name: 2-(3-bromophenyl)-6-fluoro-imidazo[1,2-a]pyridine 2-(3-bromophenyl)-6-fluoro-imida…

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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) 3.87 9.34 -6.74 0 2 0 17 291.123 1 ↓
Lo Low (pH 4.5-6) 3.87 9.77 -30.73 1 2 1 19 292.131 1 ↓

Analogs

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Popular Name: 6-fluoro-2-(4-fluoro-3-nitro-phenyl)imidazo[1,2-a]pyridine 6-fluoro-2-(4-fluoro-3-nitro-phe…

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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) 3.14 9.46 -15.67 0 5 0 63 275.214 2 ↓

Analogs

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Popular Name: 6-fluoro-2-(4-methyl-3-nitro-phenyl)imidazo[1,2-a]pyridine 6-fluoro-2-(4-methyl-3-nitro-phe…

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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) 3.42 10.05 -14.86 0 5 0 63 271.251 2 ↓

Analogs

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Popular Name: 6-chloro-2-(3,4-dichlorophenyl)imidazo[1,2-a]pyridine 6-chloro-2-(3,4-dichlorophenyl)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) 4.89 10.13 -6.37 0 2 0 17 297.572 1 ↓
Lo Low (pH 4.5-6) 4.89 10.56 -33.4 1 2 1 19 298.58 1 ↓

Analogs

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Popular Name: 6-chloro-2-(3-methoxyphenyl)imidazo[1,2-a]pyridine 6-chloro-2-(3-methoxyphenyl)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) 3.64 8.45 -10.86 0 3 0 27 258.708 2 ↓
Lo Low (pH 4.5-6) 3.64 8.89 -28.7 1 3 1 28 259.716 2 ↓

Analogs

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Popular Name: 6-chloro-2-(4-fluoro-3-nitro-phenyl)imidazo[1,2-a]pyridine 6-chloro-2-(4-fluoro-3-nitro-phe…

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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) 3.65 9.89 -15.51 0 5 0 63 291.669 2 ↓

Analogs

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Popular Name: 6-chloro-2-(4-methyl-3-nitro-phenyl)imidazo[1,2-a]pyridine 6-chloro-2-(4-methyl-3-nitro-phe…

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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) 3.94 10.48 -14.85 0 5 0 63 287.706 2 ↓

Analogs

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Popular Name: 2-(4-chlorophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine 2-(4-chlorophenyl)-6-(trifluorom…

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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) 4.50 10.14 -7.67 0 2 0 17 296.679 2 ↓

Analogs

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Popular Name: 2-(2,4-dimethylphenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine 2-(2,4-dimethylphenyl)-6-(triflu…

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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) 4.65 11.05 -7.2 0 2 0 17 290.288 2 ↓
Lo Low (pH 4.5-6) 4.65 11.57 -29.34 1 2 1 19 291.296 2 ↓

Analogs

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Popular Name: 2-(3-methoxyphenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine 2-(3-methoxyphenyl)-6-(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) 3.85 8.92 -11.08 0 3 0 27 292.26 3 ↓
Lo Low (pH 4.5-6) 3.85 9.36 -31.41 1 3 1 28 293.268 3 ↓

Analogs

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Popular Name: 6-bromo-2-(2,5-difluorophenyl)imidazo[1,2-a]pyridine 6-bromo-2-(2,5-difluorophenyl)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) 3.99 9.55 -9.11 0 2 0 17 309.113 1 ↓
Lo Low (pH 4.5-6) 3.99 9.73 -27.59 1 2 1 19 310.121 1 ↓

Analogs

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Popular Name: 2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridine-7-carboxylic 2-(2,4-dichlorophenyl)imidazo[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) 4.12 10.56 -53.12 0 4 -1 57 306.128 2 ↓
Mid Mid (pH 6-8) 4.12 10.77 -44.96 1 4 0 59 307.136 2 ↓

Analogs

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Popular Name: 2-(3,4-dichlorophenyl)imidazo[1,2-a]pyridine-7-carboxylic 2-(3,4-dichlorophenyl)imidazo[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) 4.12 10.14 -48.28 0 4 -1 57 306.128 2 ↓
Mid Mid (pH 6-8) 4.12 10.57 -48.51 1 4 0 59 307.136 2 ↓

Analogs

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Popular Name: 2-(3-bromophenyl)imidazo[1,2-a]pyridine-7-carboxylic 2-(3-bromophenyl)imidazo[1,2-a]p…

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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) 3.62 9.79 -49.2 0 4 -1 57 316.134 2 ↓
Lo Low (pH 4.5-6) 3.62 10.22 -46.01 1 4 0 59 317.142 2 ↓

Analogs

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Popular Name: [2-(4-bromophenyl)imidazo[1,2-a]pyridin-8-yl]methanol [2-(4-bromophenyl)imidazo[1,2-a]…

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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) 3.07 6.7 -10.08 1 3 0 38 303.159 2 ↓
Lo Low (pH 4.5-6) 3.07 7.13 -30.93 2 3 1 39 304.167 2 ↓

Analogs

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Popular Name: 2-(3-nitrophenyl)imidazo[1,2-a]pyridin-8-ol 2-(3-nitrophenyl)imidazo[1,2-a]p…

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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) 2.64 6.16 -23.76 1 6 0 83 255.233 2 ↓
Hi High (pH 8-9.5) 2.64 6.92 -61.52 0 6 -1 86 254.225 2 ↓
Lo Low (pH 4.5-6) 2.64 6.59 -38.5 2 6 1 85 256.241 2 ↓

Analogs

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Popular Name: 2-(4-methoxy-3-nitro-phenyl)imidazo[1,2-a]pyridin-8-ol 2-(4-methoxy-3-nitro-phenyl)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) 2.65 6.27 -27.13 1 7 0 93 285.259 3 ↓
Hi High (pH 8-9.5) 2.65 7.03 -64.85 0 7 -1 95 284.251 3 ↓
Lo Low (pH 4.5-6) 2.65 6.69 -42.09 2 7 1 94 286.267 3 ↓

Analogs

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Popular Name: 2-(4-ethoxy-3-nitro-phenyl)imidazo[1,2-a]pyridin-8-ol 2-(4-ethoxy-3-nitro-phenyl)imida…

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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) 3.03 7.17 -27.07 1 7 0 93 299.286 4 ↓
Hi High (pH 8-9.5) 3.03 7.94 -64.64 0 7 -1 95 298.278 4 ↓
Lo Low (pH 4.5-6) 3.03 7.6 -42.19 2 7 1 94 300.294 4 ↓

Analogs

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Popular Name: 2-(4-fluoro-3-nitro-phenyl)imidazo[1,2-a]pyridin-8-ol 2-(4-fluoro-3-nitro-phenyl)imida…

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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) 2.76 6.16 -24 1 6 0 83 273.223 2 ↓
Hi High (pH 8-9.5) 2.76 6.94 -58.94 0 6 -1 86 272.215 2 ↓
Lo Low (pH 4.5-6) 2.76 6.59 -43.2 2 6 1 85 274.231 2 ↓

Analogs

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Popular Name: 2-(4-dimethylaminophenyl)imidazo[1,2-a]pyridin-8-ol 2-(4-dimethylaminophenyl)imidazo…

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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) 2.81 6.23 -15.76 1 4 0 41 253.305 2 ↓
Hi High (pH 8-9.5) 2.81 6.95 -57.41 0 4 -1 44 252.297 2 ↓
Mid Mid (pH 6-8) 2.81 6.67 -27.82 2 4 1 42 254.313 2 ↓

Parameters Provided:

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filter.purchasability = annotated
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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 = 339 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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