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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: N-(4-methyl-5-methylsulfanyl-thiazol-2-yl)-1H-triazole-4-carboxamide N-(4-methyl-5-methylsulfanyl-thi…

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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) 0.91 1.75 -7.63 2 6 0 84 255.328 3 ↓
Mid Mid (pH 6-8) 0.91 1.73 -33.57 1 6 -1 82 254.32 3 ↓

Analogs

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Popular Name: N-(4,5-dimethylthiazol-2-yl)-1H-triazole-4-carboxamide N-(4,5-dimethylthiazol-2-yl)-1H-…

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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) 0.41 1.43 -11.55 2 6 0 84 223.261 2 ↓
Mid Mid (pH 6-8) 0.41 1.41 -40.78 1 6 -1 82 222.253 2 ↓

Analogs

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Popular Name: N-(4-methylthiazol-2-yl)-1H-triazole-4-carboxamide N-(4-methylthiazol-2-yl)-1H-tria…

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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) 0.19 0.37 -7.71 2 6 0 84 209.234 2 ↓
Mid Mid (pH 6-8) 0.19 0.35 -34.69 1 6 -1 82 208.226 2 ↓

Analogs

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Popular Name: N-(5-methylthiazol-2-yl)-1H-triazole-4-carboxamide N-(5-methylthiazol-2-yl)-1H-tria…

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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) 0.19 0.93 -11.15 2 6 0 84 209.234 2 ↓
Mid Mid (pH 6-8) 0.19 0.91 -39.89 1 6 -1 82 208.226 2 ↓

Analogs

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Popular Name: ethyl 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) 0.63 2.21 -13.05 2 8 0 110 281.297 6 ↓
Hi High (pH 8-9.5) 0.69 0.58 -109.86 0 8 -2 115 279.281 6 ↓
Mid Mid (pH 6-8) 0.63 2.19 -41.99 1 8 -1 108 280.289 6 ↓

Analogs

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Popular Name: N-(4-ethyl-5-methyl-thiazol-2-yl)-1H-triazole-4-carboxamide N-(4-ethyl-5-methyl-thiazol-2-yl…

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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) 0.99 1.84 -8.1 2 6 0 84 237.288 3 ↓
Mid Mid (pH 6-8) 0.99 1.82 -36 1 6 -1 82 236.28 3 ↓

Analogs

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Popular Name: N-(5-ethyl-4-propyl-thiazol-2-yl)-1H-triazole-4-carboxamide N-(5-ethyl-4-propyl-thiazol-2-yl…

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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 3.26 -7.69 2 6 0 84 265.342 5 ↓
Mid Mid (pH 6-8) 2.06 3.24 -35.68 1 6 -1 82 264.334 5 ↓

Analogs

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Popular Name: methyl 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) 0.25 1.28 -13.21 2 8 0 110 267.27 5 ↓
Hi High (pH 8-9.5) 0.32 -0.35 -109.69 0 8 -2 115 265.254 5 ↓
Mid Mid (pH 6-8) 0.25 1.26 -42.07 1 8 -1 108 266.262 5 ↓

Parameters Provided:

ring.id = 333859
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 = 333859 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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