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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: 4-(2-thienyl)imidazole-1,2-diamine 4-(2-thienyl)imidazole-1,2-diamine

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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) 0.64 4.62 -28.66 5 4 1 71 181.244 1 ↓
Hi High (pH 8-9.5) 0.64 4.17 -8.69 4 4 0 70 180.236 1 ↓

Analogs

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Popular Name: 3-[4-(2-thienyl)imidazol-1-yl]propanoic 3-[4-(2-thienyl)imidazol-1-yl]pr…

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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) 0.97 8.12 -42.23 0 4 -1 58 221.261 4 ↓
Mid Mid (pH 6-8) 0.97 8.6 -45.91 1 4 0 59 222.269 4 ↓

Analogs

44651822
44651822
44652040
44652040

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Popular Name: [5-(5-chloro-2-thienyl)-1H-imidazol-2-yl]methanamine [5-(5-chloro-2-thienyl)-1H-imida…

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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) 1.47 2.61 -50.61 4 3 1 56 214.701 2 ↓
Hi High (pH 8-9.5) 1.47 2.18 -5.79 3 3 0 55 213.693 2 ↓
Hi High (pH 8-9.5) 1.47 2.22 -7.91 3 3 0 55 213.693 2 ↓

Analogs

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Popular Name: 2-[5-(5-chloro-2-thienyl)-1H-imidazol-2-yl]ethanamine 2-[5-(5-chloro-2-thienyl)-1H-imi…

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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) 1.27 3.34 -50.31 4 3 1 56 228.728 3 ↓
Lo Low (pH 4.5-6) 1.27 3.74 -111.4 5 3 2 58 229.736 3 ↓
Lo Low (pH 4.5-6) 1.27 3.74 -111.79 5 3 2 58 229.736 3 ↓

Analogs

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Popular Name: 2-methyl-N-[[5-methyl-4-(2-thienyl)-1H-imidazol-2-yl]methyl]propan-2-amine 2-methyl-N-[[5-methyl-4-(2-thien…

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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) 2.45 6.1 -39.24 3 3 1 45 250.391 4 ↓
Hi High (pH 8-9.5) 2.45 4.9 -6.26 2 3 0 41 249.383 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-methyl-N-[[5-methyl-4-(2-thienyl)-1H-imidazol-2-yl]methyl]propan-1-amine 2-methyl-N-[[5-methyl-4-(2-thien…

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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 6.58 -44.11 3 3 1 45 250.391 5 ↓
Hi High (pH 8-9.5) 2.39 5.41 -6.3 2 3 0 41 249.383 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-methoxy-N-[[5-methyl-4-(2-thienyl)-1H-imidazol-2-yl]methyl]ethanamine 2-methoxy-N-[[5-methyl-4-(2-thie…

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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) 1.25 4.27 -44.6 3 4 1 55 252.363 6 ↓
Hi High (pH 8-9.5) 1.25 2.9 -9.03 2 4 0 50 251.355 6 ↓
Mid Mid (pH 6-8) 1.25 3.57 -27.6 3 4 1 51 252.363 6 ↓

Parameters Provided:

ring.id = 25830
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 = 25830 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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