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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

12528798
12528798

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Popular Name: 2-[2-[(4-chlorophenoxy)methyl]benzimidazol-1-yl]-N-cyclohexyl-N-methyl-acetamide 2-[2-[(4-chlorophenoxy)methyl]be…

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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) 5.19 12.63 -15.65 0 5 0 47 411.933 6 ↓
Lo Low (pH 4.5-6) 5.19 13.3 -36.14 1 5 1 49 412.941 6 ↓

Analogs

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Popular Name: N-cyclohexyl-2-[2-[(2,4-dichlorophenoxy)methyl]benzimidazol-1-yl]-N-methyl-acetamide N-cyclohexyl-2-[2-[(2,4-dichloro…

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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) 5.79 13.18 -15.96 0 5 0 47 446.378 6 ↓
Lo Low (pH 4.5-6) 5.79 13.85 -37.51 1 5 1 49 447.386 6 ↓

Analogs

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Popular Name: 2-[2-[(2-chlorophenoxy)methyl]benzimidazol-1-yl]-N-cyclohexyl-N-methyl-acetamide 2-[2-[(2-chlorophenoxy)methyl]be…

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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) 5.14 12.67 -17.12 0 5 0 47 411.933 6 ↓
Lo Low (pH 4.5-6) 5.14 13.33 -35.12 1 5 1 49 412.941 6 ↓

Analogs

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Popular Name: N-cyclohexyl-2-[2-[(2-methoxyphenoxy)methyl]benzimidazol-1-yl]-N-methyl-acetamide N-cyclohexyl-2-[2-[(2-methoxyphe…

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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 12.01 -18.99 0 6 0 57 407.514 7 ↓
Lo Low (pH 4.5-6) 4.12 12.66 -34.29 1 6 1 58 408.522 7 ↓

Analogs

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Popular Name: N-cyclohexyl-2-[2-[(2-isopropyl-5-methyl-phenoxy)methyl]benzimidazol-1-yl]-N-methyl-acetamide N-cyclohexyl-2-[2-[(2-isopropyl-…

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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) 5.93 14.8 -16.16 0 5 0 47 433.596 7 ↓
Lo Low (pH 4.5-6) 5.93 15.47 -33.21 1 5 1 49 434.604 7 ↓

Analogs

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Popular Name: N-cyclohexyl-N-methyl-2-[2-[(2-methylphenoxy)methyl]benzimidazol-1-yl]acetamide N-cyclohexyl-N-methyl-2-[2-[(2-m…

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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) 4.91 12.87 -16.29 0 5 0 47 391.515 6 ↓
Lo Low (pH 4.5-6) 4.91 13.54 -33.49 1 5 1 49 392.523 6 ↓

Analogs

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Popular Name: N-cyclohexyl-N-methyl-2-[2-[(3-methylphenoxy)methyl]benzimidazol-1-yl]acetamide N-cyclohexyl-N-methyl-2-[2-[(3-m…

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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) 4.93 12.79 -16.48 0 5 0 47 391.515 6 ↓
Lo Low (pH 4.5-6) 4.93 13.46 -33.35 1 5 1 49 392.523 6 ↓

Analogs

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Popular Name: N-cyclohexyl-2-[2-[(2,5-dimethylphenoxy)methyl]benzimidazol-1-yl]-N-methyl-acetamide N-cyclohexyl-2-[2-[(2,5-dimethyl…

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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) 5.34 13.53 -16.33 0 5 0 47 405.542 6 ↓
Lo Low (pH 4.5-6) 5.34 14.21 -33.4 1 5 1 49 406.55 6 ↓

Analogs

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Popular Name: N-cyclohexyl-2-[2-[(3-methoxyphenoxy)methyl]benzimidazol-1-yl]-N-methyl-acetamide N-cyclohexyl-2-[2-[(3-methoxyphe…

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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) 4.54 11.41 -17.85 0 6 0 57 407.514 7 ↓
Lo Low (pH 4.5-6) 4.54 12.08 -35.9 1 6 1 58 408.522 7 ↓

Analogs

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Popular Name: N-cyclohexyl-N-methyl-2-[2-[(4-methylphenoxy)methyl]benzimidazol-1-yl]acetamide N-cyclohexyl-N-methyl-2-[2-[(4-m…

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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) 4.96 12.79 -16.31 0 5 0 47 391.515 6 ↓
Lo Low (pH 4.5-6) 4.96 13.46 -33.24 1 5 1 49 392.523 6 ↓

Analogs

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Popular Name: N-cyclohexyl-2-[2-[(4-ethylphenoxy)methyl]benzimidazol-1-yl]-N-methyl-acetamide N-cyclohexyl-2-[2-[(4-ethylpheno…

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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) 5.43 13.55 -16.07 0 5 0 47 405.542 7 ↓
Lo Low (pH 4.5-6) 5.43 14.23 -33.17 1 5 1 49 406.55 7 ↓

Analogs

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Popular Name: N-cyclohexyl-2-[2-[(4-methoxyphenoxy)methyl]benzimidazol-1-yl]-N-methyl-acetamide N-cyclohexyl-2-[2-[(4-methoxyphe…

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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) 4.57 11.41 -17.19 0 6 0 57 407.514 7 ↓
Lo Low (pH 4.5-6) 4.57 12.07 -35.49 1 6 1 58 408.522 7 ↓

Analogs

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Popular Name: N-cyclohexyl-2-[2-[(4-isopropylphenoxy)methyl]benzimidazol-1-yl]-N-methyl-acetamide N-cyclohexyl-2-[2-[(4-isopropylp…

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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) 6.02 14.04 -15.92 0 5 0 47 419.569 7 ↓
Lo Low (pH 4.5-6) 6.02 14.71 -33.12 1 5 1 49 420.577 7 ↓

Analogs

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Popular Name: 2-[2-[(4-tert-butylphenoxy)methyl]benzimidazol-1-yl]-N-cyclohexyl-N-methyl-acetamide 2-[2-[(4-tert-butylphenoxy)methy…

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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 14.43 -15.86 0 5 0 47 433.596 7 ↓
Lo Low (pH 4.5-6) 6.22 15.11 -33.11 1 5 1 49 434.604 7 ↓

Analogs

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Popular Name: N-cyclohexyl-N-methyl-2-[2-[(1S)-1-phenoxyethyl]benzimidazol-1-yl]acetamide N-cyclohexyl-N-methyl-2-[2-[(1S)…

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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) 4.87 12.51 -18.44 0 5 0 47 391.515 6 ↓
Lo Low (pH 4.5-6) 4.87 12.99 -29.74 1 5 1 49 392.523 6 ↓

Analogs

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Popular Name: N-cyclohexyl-N-methyl-2-[2-[(1R)-1-phenoxyethyl]benzimidazol-1-yl]acetamide N-cyclohexyl-N-methyl-2-[2-[(1R)…

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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) 4.87 12.52 -21.77 0 5 0 47 391.515 6 ↓
Lo Low (pH 4.5-6) 4.87 13.27 -29.49 1 5 1 49 392.523 6 ↓

Analogs

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Popular Name: 2-[2-[(1S)-1-(4-chlorophenoxy)ethyl]benzimidazol-1-yl]-N-cyclohexyl-N-methyl-acetamide 2-[2-[(1S)-1-(4-chlorophenoxy)et…

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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) 5.55 13.02 -17.43 0 5 0 47 425.96 6 ↓
Lo Low (pH 4.5-6) 5.55 13.51 -32.01 1 5 1 49 426.968 6 ↓

Analogs

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Popular Name: 2-[2-[(1R)-1-(4-chlorophenoxy)ethyl]benzimidazol-1-yl]-N-cyclohexyl-N-methyl-acetamide 2-[2-[(1R)-1-(4-chlorophenoxy)et…

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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) 5.55 13.02 -20.39 0 5 0 47 425.96 6 ↓
Lo Low (pH 4.5-6) 5.55 13.79 -32.31 1 5 1 49 426.968 6 ↓

Parameters Provided:

ring.id = 7702
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 = 7702 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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