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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-ethyl-4-piperidyl)methyl]benzimidazol-5-amine 1-[(1-ethyl-4-piperidyl)methyl]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) 1.73 8 -43.48 3 4 1 48 259.377 3 ↓
Mid Mid (pH 6-8) 1.73 8.48 -83.97 4 4 2 50 260.385 3 ↓

Analogs

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Popular Name: 1-[(1-ethyl-4-piperidyl)methyl]-2-methyl-benzimidazol-5-amine 1-[(1-ethyl-4-piperidyl)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) 1.82 7.65 -44.78 3 4 1 48 273.404 3 ↓
Mid Mid (pH 6-8) 1.82 8.09 -82.63 4 4 2 50 274.412 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-ethyl-1-[(1-ethyl-4-piperidyl)methyl]benzimidazol-5-amine 2-ethyl-1-[(1-ethyl-4-piperidyl)…

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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) 2.39 8.53 -44.28 3 4 1 48 287.431 4 ↓
Mid Mid (pH 6-8) 2.39 8.82 -78.96 4 4 2 50 288.439 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(1-methyl-4-piperidyl)methyl]benzimidazol-5-amine 1-[(1-methyl-4-piperidyl)methyl]…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.35 7.33 -44.62 3 4 1 48 245.35 2 ↓
Mid Mid (pH 6-8) 1.35 7.82 -84.23 4 4 2 50 246.358 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-methyl-1-[(1-methyl-4-piperidyl)methyl]benzimidazol-5-amine 2-methyl-1-[(1-methyl-4-piperidy…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.44 7.28 -45.44 3 4 1 48 259.377 2 ↓
Mid Mid (pH 6-8) 1.44 7.72 -80.23 4 4 2 50 260.385 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-ethyl-1-[(1-methyl-4-piperidyl)methyl]benzimidazol-5-amine 2-ethyl-1-[(1-methyl-4-piperidyl…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 2.01 7.88 -45.46 3 4 1 48 273.404 3 ↓
Mid Mid (pH 6-8) 2.01 8.16 -79.23 4 4 2 50 274.412 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(1-methyl-4-piperidyl)methyl]-2-propyl-benzimidazol-5-amine 1-[(1-methyl-4-piperidyl)methyl]…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 2.52 8.66 -45.48 3 4 1 48 287.431 4 ↓
Mid Mid (pH 6-8) 2.52 8.94 -79.77 4 4 2 50 288.439 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-isopropyl-1-[(1-methyl-4-piperidyl)methyl]benzimidazol-5-amine 2-isopropyl-1-[(1-methyl-4-piper…

Find On: PubMed — Wikipedia — Google

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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) 2.50 8.49 -44.97 3 4 1 48 287.431 3 ↓
Mid Mid (pH 6-8) 2.50 9.05 -78.51 4 4 2 50 288.439 3 ↓

Parameters Provided:

ring.id = 28432
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 = 28432 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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