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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-[1-[2-(5,6-dimethylbenzimidazol-1-yl)ethyl]triazol-4-yl]-N-methyl-methanamine 1-[1-[2-(5,6-dimethylbenzimidazo…

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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) 1.64 7.56 -50.35 2 6 1 65 285.375 5 ↓
Hi High (pH 8-9.5) 1.64 6.11 -14.09 1 6 0 61 284.367 5 ↓
Mid Mid (pH 6-8) 1.64 8.04 -89.11 3 6 2 66 286.383 5 ↓

Analogs

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Popular Name: [1-[2-(5,6-dimethylbenzimidazol-1-yl)ethyl]triazol-4-yl]methanamine [1-[2-(5,6-dimethylbenzimidazol-…

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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) 1.26 5.69 -55.55 3 6 1 76 271.348 4 ↓
Hi High (pH 8-9.5) 1.26 5.29 -12.85 2 6 0 75 270.34 4 ↓
Mid Mid (pH 6-8) 1.26 6.17 -93.84 4 6 2 77 272.356 4 ↓

Analogs

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Popular Name: 1-[1-[2-(benzimidazol-1-yl)ethyl]triazol-4-yl]-N-methyl-methanamine 1-[1-[2-(benzimidazol-1-yl)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) 0.84 6.34 -50.35 2 6 1 65 257.321 5 ↓
Hi High (pH 8-9.5) 0.84 4.88 -12.53 1 6 0 61 256.313 5 ↓
Mid Mid (pH 6-8) 0.84 6.81 -88.96 3 6 2 66 258.329 5 ↓

Analogs

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Popular Name: N-[[1-[2-(benzimidazol-1-yl)ethyl]triazol-4-yl]methyl]ethanamine N-[[1-[2-(benzimidazol-1-yl)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) 1.21 7.19 -49.76 2 6 1 65 271.348 6 ↓
Hi High (pH 8-9.5) 1.21 5.82 -12.41 1 6 0 61 270.34 6 ↓
Mid Mid (pH 6-8) 1.21 7.67 -88.65 3 6 2 66 272.356 6 ↓

Analogs

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Popular Name: N-[[1-[2-(benzimidazol-1-yl)ethyl]triazol-4-yl]methyl]propan-1-amine N-[[1-[2-(benzimidazol-1-yl)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) 1.71 7.95 -50.53 2 6 1 65 285.375 7 ↓
Mid Mid (pH 6-8) 1.71 8.43 -89.84 3 6 2 66 286.383 7 ↓

Analogs

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Popular Name: N-[[1-[2-(benzimidazol-1-yl)ethyl]triazol-4-yl]methyl]propan-2-amine N-[[1-[2-(benzimidazol-1-yl)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) 1.51 7.72 -48.62 2 6 1 65 285.375 6 ↓
Hi High (pH 8-9.5) 1.51 6.52 -12.24 1 6 0 61 284.367 6 ↓
Mid Mid (pH 6-8) 1.51 8.2 -87.06 3 6 2 66 286.383 6 ↓

Analogs

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Popular Name: [1-[2-(benzimidazol-1-yl)ethyl]triazol-4-yl]methanamine [1-[2-(benzimidazol-1-yl)ethyl]t…

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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) 0.46 4.46 -55.53 3 6 1 76 243.294 4 ↓
Hi High (pH 8-9.5) 0.46 4.06 -12.84 2 6 0 75 242.286 4 ↓
Mid Mid (pH 6-8) 0.46 4.94 -93.66 4 6 2 77 244.302 4 ↓

Analogs

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Popular Name: 1-[2-(2-ethylbenzimidazol-1-yl)ethyl]triazole-4-carboxylic 1-[2-(2-ethylbenzimidazol-1-yl)e…

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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 7.3 -51.58 0 7 -1 89 284.299 5 ↓
Mid Mid (pH 6-8) 1.51 7.59 -62.96 1 7 0 90 285.307 5 ↓

Parameters Provided:

ring.id = 260476
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 = 260476 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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