UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 8-[(2-chloro-4-pyridyl)sulfonyl]-8-azaspiro[4.5]decane 8-[(2-chloro-4-pyridyl)sulfonyl]…

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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) 2.87 5.25 -8.49 0 4 0 50 314.838 2 ↓

Analogs

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Popular Name: [4-(8-azaspiro[4.5]decan-8-ylsulfonyl)-2-pyridyl]hydrazine [4-(8-azaspiro[4.5]decan-8-ylsul…

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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) 1.43 3.47 -9.86 3 6 0 88 310.423 3 ↓

Analogs

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Popular Name: 4-(8-azaspiro[4.5]decan-8-ylsulfonyl)pyridin-2-amine 4-(8-azaspiro[4.5]decan-8-ylsulf…

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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) 1.67 3.57 -9.14 2 5 0 76 295.408 2 ↓

Analogs

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Popular Name: 4-(8-azaspiro[4.5]decan-8-ylsulfonyl)-N-methyl-pyridin-2-amine 4-(8-azaspiro[4.5]decan-8-ylsulf…

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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) 2.05 4.47 -9.14 1 5 0 62 309.435 3 ↓

Parameters Provided:

ring.id = 319166
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 = 319166 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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