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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-phenylpropyl)benzimidazol-5-amine 1-(3-phenylpropyl)benzimidazol-5…

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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) 2.87 9.16 -11.07 2 3 0 44 251.333 4 ↓
Mid Mid (pH 6-8) 2.87 9.64 -33.93 3 3 1 45 252.341 4 ↓

Analogs

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Popular Name: 2-methyl-1-(3-phenylpropyl)benzimidazol-5-amine 2-methyl-1-(3-phenylpropyl)benzi…

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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) 2.96 9.4 -29.29 3 3 1 45 266.368 4 ↓
Mid Mid (pH 6-8) 2.96 8.96 -11.64 2 3 0 44 265.36 4 ↓

Analogs

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Popular Name: 2-ethyl-1-(3-phenylpropyl)benzimidazol-5-amine 2-ethyl-1-(3-phenylpropyl)benzim…

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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 9.86 -28.06 3 3 1 45 280.395 5 ↓
Mid Mid (pH 6-8) 3.53 9.57 -11.21 2 3 0 44 279.387 5 ↓

Analogs

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Popular Name: 1-[(1S)-1-methyl-3-phenyl-propyl]benzimidazol-5-amine 1-[(1S)-1-methyl-3-phenyl-propyl…

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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) 3.23 9.39 -10.27 2 3 0 44 265.36 4 ↓
Mid Mid (pH 6-8) 3.23 9.88 -31.25 3 3 1 45 266.368 4 ↓

Analogs

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Popular Name: 1-[(1R)-1-methyl-3-phenyl-propyl]benzimidazol-5-amine 1-[(1R)-1-methyl-3-phenyl-propyl…

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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) 3.23 9.39 -10.29 2 3 0 44 265.36 4 ↓
Mid Mid (pH 6-8) 3.23 9.88 -31.17 3 3 1 45 266.368 4 ↓

Analogs

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Popular Name: 2-methyl-1-[(1S)-1-methyl-3-phenyl-propyl]benzimidazol-5-amine 2-methyl-1-[(1S)-1-methyl-3-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) 3.32 9.56 -28.47 3 3 1 45 280.395 4 ↓
Mid Mid (pH 6-8) 3.32 9.12 -11.17 2 3 0 44 279.387 4 ↓

Analogs

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Popular Name: 2-methyl-1-[(1R)-1-methyl-3-phenyl-propyl]benzimidazol-5-amine 2-methyl-1-[(1R)-1-methyl-3-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) 3.32 9.57 -28.53 3 3 1 45 280.395 4 ↓
Mid Mid (pH 6-8) 3.32 9.13 -11.21 2 3 0 44 279.387 4 ↓

Analogs

33828145
33828145
33828147
33828147
33828148
33828148
33828154
33828154
33828156
33828156

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Popular Name: N-methyl-N-[[1-(3-phenylpropyl)benzimidazol-2-yl]methyl]acetamide N-methyl-N-[[1-(3-phenylpropyl)b…

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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) 3.09 11.45 -10.05 0 4 0 38 321.424 6 ↓
Mid Mid (pH 6-8) 3.09 11.86 -32.35 1 4 1 39 322.432 6 ↓

Analogs

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Popular Name: 1-(3-phenylpropyl)-1H-1,3-benzodiazol-2-amine 1-(3-phenylpropyl)-1H-1,3-benzod…

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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 11.24 -29.9 3 3 1 45 252.341 4 ↓

Analogs

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Popular Name: 5-chloro-1-(3-phenylpropyl)-1H-1,3-benzodiazol-2-amine 5-chloro-1-(3-phenylpropyl)-1H-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) 4.28 11.28 -10.27 2 3 0 44 285.778 4 ↓
Mid Mid (pH 6-8) 4.28 11.75 -32.84 3 3 1 45 286.786 4 ↓

Analogs

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Popular Name: 5-fluoro-1-(3-phenylpropyl)benzimidazol-2-amine 5-fluoro-1-(3-phenylpropyl)benzi…

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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) 3.76 11.31 -33.33 3 3 1 45 270.331 4 ↓

Analogs

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Popular Name: 7-chloro-1-(3-phenylpropyl)benzimidazol-2-amine 7-chloro-1-(3-phenylpropyl)benzi…

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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) 4.25 11.09 -9.11 2 3 0 44 285.778 4 ↓
Mid Mid (pH 6-8) 4.25 11.56 -31.35 3 3 1 45 286.786 4 ↓

Analogs

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Popular Name: 5-methyl-1-(3-phenylpropyl)benzimidazol-2-amine 5-methyl-1-(3-phenylpropyl)benzi…

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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) 4.05 11.91 -29.89 3 3 1 45 266.368 4 ↓

Analogs

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Popular Name: 4-fluoro-1-(3-phenylpropyl)benzimidazol-2-amine 4-fluoro-1-(3-phenylpropyl)benzi…

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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) 3.74 10.84 -13.55 2 3 0 44 269.323 4 ↓
Mid Mid (pH 6-8) 3.74 11.31 -31.69 3 3 1 45 270.331 4 ↓

Analogs

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Popular Name: 2-(chloromethyl)-5-fluoro-1-(3-phenylpropyl)benzimidazole 2-(chloromethyl)-5-fluoro-1-(3-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) 4.64 11.65 -10.07 0 2 0 18 302.78 5 ↓
Lo Low (pH 4.5-6) 4.64 12.09 -33.29 1 2 1 19 303.788 5 ↓

Analogs

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Popular Name: 2-(2-chloroethyl)-1-(3-phenylpropyl)benzimidazole 2-(2-chloroethyl)-1-(3-phenylpro…

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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) 4.71 12.33 -9.4 0 2 0 18 298.817 6 ↓
Mid Mid (pH 6-8) 4.71 12.62 -31.19 1 2 1 19 299.825 6 ↓

Analogs

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Popular Name: 2-(chloromethyl)-4-fluoro-1-(3-phenylpropyl)benzimidazole 2-(chloromethyl)-4-fluoro-1-(3-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) 4.62 11.64 -12.62 0 2 0 18 302.78 5 ↓
Lo Low (pH 4.5-6) 4.62 12.08 -31.86 1 2 1 19 303.788 5 ↓

Parameters Provided:

ring.id = 26912
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 = 26912 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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