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Analogs

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Popular Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide N-(5-butyl-1,3,4-thiadiazol-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) 4.00 8.13 -44.78 1 10 -1 149 474.544 9 ↓
Hi High (pH 8-9.5) 4.06 7.23 -101.3 0 10 -2 155 473.536 9 ↓
Mid Mid (pH 6-8) 4.00 8.06 -25.46 2 10 0 147 475.552 9 ↓

Analogs

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Popular Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-4-[(2,5-dimethylphenyl)sulfonylamino]benzamide N-(5-butyl-1,3,4-thiadiazol-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) 4.48 8.72 -22.23 2 7 0 101 444.582 8 ↓
Hi High (pH 8-9.5) 4.48 8.79 -47.72 1 7 -1 103 443.574 8 ↓
Hi High (pH 8-9.5) 4.55 7.88 -99.92 0 7 -2 109 442.566 8 ↓

Analogs

25445374
25445374
25445382
25445382

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Popular Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-4-[(4-fluorophenyl)sulfonylamino]benzamide N-(5-butyl-1,3,4-thiadiazol-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) 3.82 7.19 -24.77 2 7 0 101 434.518 8 ↓
Hi High (pH 8-9.5) 3.89 6.34 -93.85 0 7 -2 109 432.502 8 ↓
Mid Mid (pH 6-8) 3.82 7.25 -47.19 1 7 -1 103 433.51 8 ↓

Analogs

25445394
25445394
25445576
25445576

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Popular Name: 4-(benzenesulfonamido)-N-(5-butyl-1,3,4-thiadiazol-2-yl)benzamide 4-(benzenesulfonamido)-N-(5-buty…

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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) 3.66 7.12 -25.48 2 7 0 101 416.528 8 ↓
Hi High (pH 8-9.5) 3.73 6.28 -99.61 0 7 -2 109 414.512 8 ↓
Hi High (pH 8-9.5) 3.73 6.21 -51.36 1 7 -1 107 415.52 8 ↓

Parameters Provided:

ring.id = 119377
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 = 119377 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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