UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 6-amino-N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)pyridine-3-sulfonamide 6-amino-N-(3-cyano-5,6-dihydro-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) 1.58 3.35 -43.01 3 6 0 112 320.399 3 ↓
Hi High (pH 8-9.5) 1.58 2.86 -43.56 2 6 -1 111 319.391 3 ↓
Lo Low (pH 4.5-6) 1.58 2.94 -44.92 4 6 1 110 321.407 3 ↓

Analogs

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Popular Name: 2-(3-pyridylsulfonylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic 2-(3-pyridylsulfonylamino)-5,6-d…

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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) 1.57 4 -56.68 1 6 -1 99 323.375 4 ↓
Mid Mid (pH 6-8) 1.57 4.35 -131.08 0 6 -2 101 322.367 4 ↓

Parameters Provided:

ring.id = 533180
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 = 533180 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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