UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

8952753
8952753
8952754
8952754

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Activity (Go SEA)

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) 0.01 -6.9 -18.2 7 11 0 186 450.396 3
Hi High (pH 8-9.5) 0.01 -5.91 -56.04 6 11 -1 189 449.388 3

Parameters Provided:

ring.id = 169785
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 = 169785 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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