UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: N-(2,3-dimethyl-5-sulfamoyl-phenyl)-7-methyl-imidazo[1,2-a]pyridine-2-carboxamide N-(2,3-dimethyl-5-sulfamoyl-phen…

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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 4 -18.45 3 7 0 107 358.423 3 ↓

Analogs

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Popular Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-7-methyl-imidazo[1,2-a]pyridine-2-carboxamide N-[2-(2-methoxyethoxy)-5-(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) 3.60 8.25 -14.47 1 6 0 65 393.365 7 ↓

Analogs

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Popular Name: N-(2-acetylphenyl)-7-methyl-imidazo[1,2-a]pyridine-2-carboxamide N-(2-acetylphenyl)-7-methyl-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) 2.68 8.63 -16.65 1 5 0 63 293.326 3 ↓

Analogs

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Popular Name: N-(4-acetamido-3-chloro-phenyl)-5-methyl-imidazo[1,2-a]pyridine-2-carboxamide N-(4-acetamido-3-chloro-phenyl)-…

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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) 2.09 7 -14.41 2 6 0 76 342.786 3 ↓

Analogs

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Popular Name: N-(4-amino-3,5-dichloro-phenyl)-7-methyl-imidazo[1,2-a]pyridine-2-carboxamide N-(4-amino-3,5-dichloro-phenyl)-…

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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) 3.53 6.66 -9.65 3 5 0 72 335.194 2 ↓

Analogs

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Popular Name: 5-methyl-N-(2-methylsulfanylphenyl)imidazo[1,2-a]pyridine-2-carboxamide 5-methyl-N-(2-methylsulfanylphen…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.65 8.59 -12.63 1 4 0 46 297.383 3 ↓

Analogs

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Popular Name: Imidazo[1,2-a]pyridine-2-carboxamide, 5-methyl-N-phenyl- Imidazo[1,2-a]pyridine-2-carboxa…

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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 7.45 -11.27 1 4 0 46 251.289 2 ↓

Analogs

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Popular Name: N-(2-acetylphenyl)-5-methyl-imidazo[1,2-a]pyridine-2-carboxamide N-(2-acetylphenyl)-5-methyl-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) 2.12 8.33 -17.1 1 5 0 63 293.326 3 ↓

Analogs

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Popular Name: N-(4-fluoro-3-nitro-phenyl)-5-methyl-imidazo[1,2-a]pyridine-2-carboxamide N-(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) 2.32 8.19 -16.84 1 7 0 92 314.276 3 ↓

Analogs

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Popular Name: N-(2-cyanoethyl)-N-(4-ethoxyphenyl)-7-methyl-imidazo[1,2-a]pyridine-2-carboxamide N-(2-cyanoethyl)-N-(4-ethoxyphen…

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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) 2.97 11.38 -11.72 0 6 0 71 348.406 6 ↓
Lo Low (pH 4.5-6) 2.97 11.56 -36.23 1 6 1 72 349.414 6 ↓

Analogs

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Popular Name: N-[4-(hydroxymethyl)phenyl]-5-methyl-imidazo[1,2-a]pyridine-2-carboxamide N-[4-(hydroxymethyl)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) 1.60 4.78 -13.51 2 5 0 67 281.315 3 ↓

Analogs

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Popular Name: N-[4-(hydroxymethyl)phenyl]imidazo[1,2-a]pyridine-2-carboxamide N-[4-(hydroxymethyl)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) 1.77 4.32 -13.84 2 5 0 67 267.288 3 ↓

Analogs

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Popular Name: N-(4-chloro-3-fluoro-phenyl)imidazo[1,2-a]pyridine-2-carboxamide N-(4-chloro-3-fluoro-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) 3.20 7.55 -11.82 1 4 0 46 289.697 2 ↓

Analogs

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Popular Name: 5-methyl-N-[2-(methylcarbamoyl)phenyl]imidazo[1,2-a]pyridine-2-carboxamide 5-methyl-N-[2-(methylcarbamoyl)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) 1.41 6.22 -18.72 2 6 0 76 308.341 3 ↓

Analogs

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Popular Name: N-[2-(hydroxymethyl)phenyl]-5-methyl-imidazo[1,2-a]pyridine-2-carboxamide N-[2-(hydroxymethyl)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) 1.56 5.08 -12.26 2 5 0 67 281.315 3 ↓

Analogs

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Popular Name: N-[2-(hydroxymethyl)phenyl]imidazo[1,2-a]pyridine-2-carboxamide N-[2-(hydroxymethyl)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) 1.72 4.61 -12.63 2 5 0 67 267.288 3 ↓

Analogs

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Popular Name: N-[4-(dimethylamino)-2-(trifluoromethyl)phenyl]-5-methyl-imidazo[1,2-a]pyridine-2-carboxamide N-[4-(dimethylamino)-2-(trifluor…

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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) 3.19 9.13 -11.69 1 5 0 50 362.355 4 ↓

Analogs

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Popular Name: N-[2-[(1S)-1-hydroxyethyl]phenyl]imidazo[1,2-a]pyridine-2-carboxamide N-[2-[(1S)-1-hydroxyethyl]phenyl…

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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 5.38 -12.53 2 5 0 67 281.315 3 ↓

Analogs

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Popular Name: N-[2-[(1R)-1-hydroxyethyl]phenyl]imidazo[1,2-a]pyridine-2-carboxamide N-[2-[(1R)-1-hydroxyethyl]phenyl…

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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 5.43 -12.58 2 5 0 67 281.315 3 ↓

Analogs

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Popular Name: N-(2-chloro-4-iodo-phenyl)imidazo[1,2-a]pyridine-2-carboxamide N-(2-chloro-4-iodo-phenyl)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) 4.12 8.7 -8.88 1 4 0 46 397.603 2 ↓

Parameters Provided:

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filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

SQL Query Was

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 = 20120 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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