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

25388529
25388529

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Popular Name: N-(4-amino-3,5-dichloro-phenyl)-2-methyl-4-phenyl-thiazole-5-carboxamide N-(4-amino-3,5-dichloro-phenyl)-…

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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) 4.08 6.99 -11.71 3 4 0 68 378.284 3 ↓

Analogs

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Popular Name: N-[5-(diethylsulfamoyl)-2-hydroxy-phenyl]-2-methyl-4-phenyl-thiazole-5-carboxamide N-[5-(diethylsulfamoyl)-2-hydrox…

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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) 3.16 5.31 -22.44 2 7 0 100 445.566 7 ↓
Mid Mid (pH 6-8) 3.16 5.78 -51.1 1 7 -1 102 444.558 7 ↓

Analogs

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Popular Name: 2-methyl-N-(m-tolyl)-4-(4-nitrophenyl)thiazole-5-carboxamide 2-methyl-N-(m-tolyl)-4-(4-nitrop…

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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) 3.77 -0.16 -11.51 1 6 0 87 353.403 4 ↓

Analogs

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Popular Name: 2-amino-N-(2,5-dichlorophenyl)-4-phenyl-thiazole-5-carboxamide 2-amino-N-(2,5-dichlorophenyl)-4…

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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) 4.56 -3.19 -9.89 3 4 0 68 364.257 3 ↓
Lo Low (pH 4.5-6) 4.56 -3.09 -35.55 4 4 1 69 365.265 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-amino-N-(2,5-dichlorophenyl)-4-(4-nitrophenyl)thiazole-5-carboxamide 2-amino-N-(2,5-dichlorophenyl)-4…

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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) 4.52 8.07 -11.03 3 7 0 114 409.254 4 ↓
Lo Low (pH 4.5-6) 4.52 -2.58 -47.25 4 7 1 115 410.262 4 ↓

Analogs

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Popular Name: 2-(allylamino)-4-(4-nitrophenyl)-N-phenyl-thiazole-5-carboxamide 2-(allylamino)-4-(4-nitrophenyl)…

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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) 4.25 -1.58 -11.02 2 7 0 99 380.429 7 ↓

Analogs

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Popular Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-methyl-4-phenyl-1,3-thiazole-5-carboxamide N-[4-chloro-3-(trifluoromethyl)p…

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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) 4.89 0.93 -12.89 1 3 0 41 396.821 4 ↓

Analogs

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Popular Name: 2-[2-(dimethylamino)-2-oxo-ethyl]-N-(3-methoxyphenyl)-4-phenyl-thiazole-5-carboxamide 2-[2-(dimethylamino)-2-oxo-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) 2.52 7.51 -21.22 1 6 0 72 395.484 6 ↓

Parameters Provided:

ring.id = 104498
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 = 104498 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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