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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: N-[2-[1-[4-(2-chlorophenoxy)butyl]benzimidazol-2-yl]ethyl]cyclohexanecarboxamide N-[2-[1-[4-(2-chlorophenoxy)buty…

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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) 6.03 13.58 -17.78 1 5 0 56 454.014 10 ↓
Mid Mid (pH 6-8) 6.03 14.01 -40.77 2 5 1 57 455.022 10 ↓

Analogs

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Popular Name: N-[2-[1-[4-(2,4-dimethylphenoxy)butyl]benzimidazol-2-yl]ethyl]cyclohexanecarboxamide N-[2-[1-[4-(2,4-dimethylphenoxy)…

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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) 6.22 14.44 -16.99 1 5 0 56 447.623 10 ↓
Mid Mid (pH 6-8) 6.22 14.73 -39.32 2 5 1 57 448.631 10 ↓

Analogs

13828238
13828238

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Popular Name: N-[2-[1-[4-(2,6-dimethylphenoxy)butyl]benzimidazol-2-yl]ethyl]cyclohexanecarboxamide N-[2-[1-[4-(2,6-dimethylphenoxy)…

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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) 6.20 14.45 -17 1 5 0 56 447.623 10 ↓
Mid Mid (pH 6-8) 6.20 14.75 -39.19 2 5 1 57 448.631 10 ↓

Analogs

38584098
38584098

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Popular Name: N-[2-[1-[4-(3-methylphenoxy)butyl]benzimidazol-2-yl]ethyl]cyclohexanecarboxamide N-[2-[1-[4-(3-methylphenoxy)buty…

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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) 5.82 13.69 -17.06 1 5 0 56 433.596 10 ↓
Mid Mid (pH 6-8) 5.82 13.99 -39.41 2 5 1 57 434.604 10 ↓

Analogs

38584094
38584094

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Popular Name: N-[2-[1-[4-(3,5-dimethylphenoxy)butyl]benzimidazol-2-yl]ethyl]cyclohexanecarboxamide N-[2-[1-[4-(3,5-dimethylphenoxy)…

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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) 6.22 14.35 -17.16 1 5 0 56 447.623 10 ↓

Analogs

40198528
40198528

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Popular Name: N-[2-[1-[4-(4-chloro-3-methyl-phenoxy)butyl]benzimidazol-2-yl]ethyl]cyclohexanecarboxamide N-[2-[1-[4-(4-chloro-3-methyl-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) 6.45 14.13 -17.07 1 5 0 56 468.041 10 ↓

Analogs

13828243
13828243

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Popular Name: N-[2-[1-[4-(4-methoxyphenoxy)butyl]benzimidazol-2-yl]ethyl]cyclohexanecarboxamide N-[2-[1-[4-(4-methoxyphenoxy)but…

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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) 5.46 12.3 -18.21 1 6 0 65 449.595 11 ↓

Analogs

40198493
40198493
13828252
13828252

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Popular Name: N-[2-[1-[4-(4-tert-butylphenoxy)butyl]benzimidazol-2-yl]ethyl]cyclohexanecarboxamide N-[2-[1-[4-(4-tert-butylphenoxy)…

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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) 7.11 15.34 -16.59 1 5 0 56 475.677 11 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-[1-[4-(4-chlorophenoxy)butyl]benzimidazol-2-yl]ethyl]cyclohexanecarboxamide N-[2-[1-[4-(4-chlorophenoxy)buty…

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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) 6.08 13.54 -16.86 1 5 0 56 454.014 10 ↓
Mid Mid (pH 6-8) 6.08 13.97 -40.43 2 5 1 57 455.022 10 ↓

Analogs

40198487
40198487

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Popular Name: N-[2-[1-[4-(2-tert-butylphenoxy)butyl]benzimidazol-2-yl]ethyl]cyclohexanecarboxamide N-[2-[1-[4-(2-tert-butylphenoxy)…

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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) 7.06 15.71 -16.39 1 5 0 56 475.677 11 ↓
Mid Mid (pH 6-8) 7.06 16.01 -39.08 2 5 1 57 476.685 11 ↓

Analogs

38594699
38594699

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Popular Name: N-[2-[1-[4-[2-[(1R)-1-methylpropyl]phenoxy]butyl]benzimidazol-2-yl]ethyl]cyclohexanecarboxamide N-[2-[1-[4-[2-[(1R)-1-methylprop…

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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) 6.73 15.7 -16.6 1 5 0 56 475.677 12 ↓
Mid Mid (pH 6-8) 6.73 15.99 -38.93 2 5 1 57 476.685 12 ↓

Analogs

38594696
38594696

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Popular Name: N-[2-[1-[4-[2-[(1S)-1-methylpropyl]phenoxy]butyl]benzimidazol-2-yl]ethyl]cyclohexanecarboxamide N-[2-[1-[4-[2-[(1S)-1-methylprop…

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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) 6.73 15.7 -16.56 1 5 0 56 475.677 12 ↓
Mid Mid (pH 6-8) 6.73 15.99 -38.98 2 5 1 57 476.685 12 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-[1-[4-(2-methoxyphenoxy)butyl]benzimidazol-2-yl]ethyl]cyclohexanecarboxamide N-[2-[1-[4-(2-methoxyphenoxy)but…

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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) 5.01 12.92 -19.34 1 6 0 65 449.595 11 ↓
Mid Mid (pH 6-8) 5.01 13.21 -40.79 2 6 1 67 450.603 11 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-[1-[4-(2-isopropyl-5-methyl-phenoxy)butyl]benzimidazol-2-yl]ethyl]cyclohexanecarboxamide N-[2-[1-[4-(2-isopropyl-5-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) 6.82 15.71 -16.78 1 5 0 56 475.677 11 ↓
Mid Mid (pH 6-8) 6.82 16.01 -39.06 2 5 1 57 476.685 11 ↓

Analogs

40198486
40198486

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-[1-[4-(2,5-dimethylphenoxy)butyl]benzimidazol-2-yl]ethyl]cyclohexanecarboxamide N-[2-[1-[4-(2,5-dimethylphenoxy)…

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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) 6.22 14.44 -17.04 1 5 0 56 447.623 10 ↓
Mid Mid (pH 6-8) 6.22 14.73 -39.35 2 5 1 57 448.631 10 ↓

Parameters Provided:

ring.id = 593242
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 = 593242 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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