UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 3-methoxy-4-methyl-N-[2-(2-pyridylsulfamoyl)ethyl]benzamide 3-methoxy-4-methyl-N-[2-(2-pyrid…

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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 3.48 -22.59 2 7 0 101 349.412 6 ↓
Mid Mid (pH 6-8) 1.52 3 -52.28 1 7 -1 99 348.404 7 ↓

Analogs

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Popular Name: 4-isopropyl-N-[2-(2-pyridylsulfamoyl)ethyl]benzamide 4-isopropyl-N-[2-(2-pyridylsulfa…

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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) 2.78 5.36 -21.17 2 6 0 91 347.44 6 ↓
Mid Mid (pH 6-8) 2.60 4.88 -51.28 1 6 -1 90 346.432 7 ↓

Analogs

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Popular Name: 4-ethoxy-N-[2-(2-pyridylsulfamoyl)ethyl]benzamide 4-ethoxy-N-[2-(2-pyridylsulfamoy…

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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 3.69 -21.62 2 7 0 101 349.412 7 ↓
Mid Mid (pH 6-8) 1.52 3.21 -51.53 1 7 -1 99 348.404 8 ↓

Analogs

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Popular Name: 2-ethoxy-N-[2-(2-pyridylsulfamoyl)ethyl]benzamide 2-ethoxy-N-[2-(2-pyridylsulfamoy…

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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) 2.20 4.92 -25.13 2 7 0 101 349.412 7 ↓
Mid Mid (pH 6-8) 2.02 4.44 -56.54 1 7 -1 99 348.404 8 ↓

Parameters Provided:

ring.id = 429398
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 = 429398 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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