UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: N-(5-amino-2-pyridyl)-5-bromo-pyridine-3-sulfonamide N-(5-amino-2-pyridyl)-5-bromo-py…

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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) 1.52 0.87 -13.3 3 6 0 101 329.179 2 ↓
Hi High (pH 8-9.5) 1.34 0.45 -43.76 2 6 -1 100 328.171 3 ↓

Analogs

703788
703788

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Popular Name: N-(5-amino-4-methyl-2-pyridyl)-5-bromo-pyridine-3-sulfonamide N-(5-amino-4-methyl-2-pyridyl)-5…

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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) 1.89 1.63 -12.99 3 6 0 101 343.206 2 ↓
Hi High (pH 8-9.5) 1.72 1.19 -45.06 2 6 -1 100 342.198 3 ↓

Analogs

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Popular Name: 6-[(5-bromo-3-pyridyl)sulfonylamino]pyridine-3-carboxylic 6-[(5-bromo-3-pyridyl)sulfonylam…

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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) 1.44 3.63 -42.06 1 7 -1 115 357.165 3 ↓
Mid Mid (pH 6-8) 1.26 3.11 -101.03 0 7 -2 114 356.157 4 ↓

Analogs

540291
540291

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Popular Name: 5-bromo-N-(2-pyridyl)pyridine-3-sulfonamide 5-bromo-N-(2-pyridyl)pyridine-3-…

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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) 1.87 3.04 -13.89 1 5 0 75 314.164 2 ↓
Mid Mid (pH 6-8) 1.69 2.56 -42.3 0 5 -1 74 313.156 3 ↓

Analogs

44243385
44243385

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Popular Name: (NZ)-5-bromo-6-chloro-N-(1H-pyridin-2-ylidene)pyridine-3-sulfonamide (NZ)-5-bromo-6-chloro-N-(1H-pyri…

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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) 2.67 3.41 -12.8 1 5 0 75 348.609 2 ↓
Mid Mid (pH 6-8) 2.49 2.94 -38.64 0 5 -1 74 347.601 3 ↓

Parameters Provided:

ring.id = 5967
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 = 5967 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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