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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-[(1S)-2-(2-furyl)-1-methyl-ethyl]benzimidazol-5-amine 1-[(1S)-2-(2-furyl)-1-methyl-eth…

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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) 1.97 6.71 -10.1 2 4 0 57 241.294 3 ↓
Mid Mid (pH 6-8) 1.97 7.2 -33.27 3 4 1 58 242.302 3 ↓

Analogs

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Popular Name: 1-[(1R)-2-(2-furyl)-1-methyl-ethyl]benzimidazol-5-amine 1-[(1R)-2-(2-furyl)-1-methyl-eth…

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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) 1.97 6.79 -9.43 2 4 0 57 241.294 3 ↓
Mid Mid (pH 6-8) 1.97 7.28 -32.09 3 4 1 58 242.302 3 ↓

Analogs

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Popular Name: 1-[(1S)-2-(2-furyl)-1-methyl-ethyl]-2-methyl-benzimidazol-5-amine 1-[(1S)-2-(2-furyl)-1-methyl-eth…

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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) 2.06 6.45 -10.17 2 4 0 57 255.321 3 ↓
Mid Mid (pH 6-8) 2.06 6.88 -27.24 3 4 1 58 256.329 3 ↓

Analogs

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Popular Name: 1-[(1R)-2-(2-furyl)-1-methyl-ethyl]-2-methyl-benzimidazol-5-amine 1-[(1R)-2-(2-furyl)-1-methyl-eth…

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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) 2.06 6.54 -9.88 2 4 0 57 255.321 3 ↓
Mid Mid (pH 6-8) 2.06 6.97 -28.12 3 4 1 58 256.329 3 ↓

Analogs

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Popular Name: 2-ethyl-1-[(1S)-2-(2-furyl)-1-methyl-ethyl]benzimidazol-5-amine 2-ethyl-1-[(1S)-2-(2-furyl)-1-me…

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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) 2.63 7.07 -9.82 2 4 0 57 269.348 4 ↓
Mid Mid (pH 6-8) 2.63 7.46 -25.96 3 4 1 58 270.356 4 ↓

Analogs

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Popular Name: 2-ethyl-1-[(1R)-2-(2-furyl)-1-methyl-ethyl]benzimidazol-5-amine 2-ethyl-1-[(1R)-2-(2-furyl)-1-me…

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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) 2.63 7.12 -9.61 2 4 0 57 269.348 4 ↓
Mid Mid (pH 6-8) 2.63 7.54 -26.48 3 4 1 58 270.356 4 ↓

Analogs

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Popular Name: 1-[(1S)-2-(2-furyl)-1-methyl-ethyl]-2-propyl-benzimidazol-5-amine 1-[(1S)-2-(2-furyl)-1-methyl-eth…

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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) 3.14 7.81 -9.49 2 4 0 57 283.375 5 ↓
Mid Mid (pH 6-8) 3.14 8.24 -25.99 3 4 1 58 284.383 5 ↓

Analogs

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Popular Name: 1-[(1R)-2-(2-furyl)-1-methyl-ethyl]-2-propyl-benzimidazol-5-amine 1-[(1R)-2-(2-furyl)-1-methyl-eth…

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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) 3.14 7.89 -9.22 2 4 0 57 283.375 5 ↓
Mid Mid (pH 6-8) 3.14 8.32 -26.48 3 4 1 58 284.383 5 ↓

Analogs

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Popular Name: 1-[(1S)-2-(2-furyl)-1-methyl-ethyl]-2-isopropyl-benzimidazol-5-amine 1-[(1S)-2-(2-furyl)-1-methyl-eth…

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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) 3.12 7.49 -9.46 2 4 0 57 283.375 4 ↓
Mid Mid (pH 6-8) 3.12 8.07 -24.46 3 4 1 58 284.383 4 ↓

Analogs

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Popular Name: 1-[(1R)-2-(2-furyl)-1-methyl-ethyl]-2-isopropyl-benzimidazol-5-amine 1-[(1R)-2-(2-furyl)-1-methyl-eth…

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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) 3.12 7.57 -9.12 2 4 0 57 283.375 4 ↓
Mid Mid (pH 6-8) 3.12 8.15 -24.95 3 4 1 58 284.383 4 ↓

Analogs

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Popular Name: 1-[2-(2-furyl)ethyl]benzimidazol-5-amine 1-[2-(2-furyl)ethyl]benzimidazol…

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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) 1.61 6.49 -10.32 2 4 0 57 227.267 3 ↓
Mid Mid (pH 6-8) 1.61 6.98 -33.26 3 4 1 58 228.275 3 ↓

Analogs

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Popular Name: 1-[2-(2-furyl)ethyl]-2-methyl-benzimidazol-5-amine 1-[2-(2-furyl)ethyl]-2-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) 1.70 6.3 -10.92 2 4 0 57 241.294 3 ↓
Mid Mid (pH 6-8) 1.70 6.73 -29.46 3 4 1 58 242.302 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-ethyl-1-[2-(2-furyl)ethyl]benzimidazol-5-amine 2-ethyl-1-[2-(2-furyl)ethyl]benz…

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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) 2.27 6.9 -10.51 2 4 0 57 255.321 4 ↓
Mid Mid (pH 6-8) 2.27 7.19 -27.82 3 4 1 58 256.329 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[2-(2-furyl)ethyl]-2-propyl-benzimidazol-5-amine 1-[2-(2-furyl)ethyl]-2-propyl-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) 2.77 7.68 -10.22 2 4 0 57 269.348 5 ↓
Mid Mid (pH 6-8) 2.77 7.97 -27.78 3 4 1 58 270.356 5 ↓

Analogs

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Popular Name: 1-[2-(2-furyl)ethyl]-2-isopropyl-benzimidazol-5-amine 1-[2-(2-furyl)ethyl]-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) 2.75 7.33 -10.14 2 4 0 57 269.348 4 ↓
Mid Mid (pH 6-8) 2.75 7.79 -26.21 3 4 1 58 270.356 4 ↓

Analogs

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Popular Name: 2-tert-butyl-1-[2-(2-furyl)ethyl]benzimidazol-5-amine 2-tert-butyl-1-[2-(2-furyl)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) 3.42 7.54 -10.04 2 4 0 57 283.375 4 ↓
Mid Mid (pH 6-8) 3.42 7.93 -24.66 3 4 1 58 284.383 4 ↓

Analogs

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Popular Name: 1-[2-(2-furyl)ethyl]-2-(trifluoromethyl)benzimidazol-5-amine 1-[2-(2-furyl)ethyl]-2-(trifluor…

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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) 2.61 6.46 -8.76 2 4 0 57 295.264 4 ↓

Parameters Provided:

ring.id = 28379
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 = 28379 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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