UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

8724927
8724927

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Popular Name: (4-fluorophenyl)-dimethyl-phenacyl-BLAHdione (4-fluorophenyl)-dimethyl-phenac…

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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) 3.16 1.81 -16.02 0 9 0 94 446.442 4 ↓
Mid Mid (pH 6-8) 3.16 2.08 -40.9 1 9 1 95 447.45 4 ↓

Analogs

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Popular Name: [2-(4-chlorophenyl)-2-oxo-ethyl]-(4-fluorophenyl)-dimethyl-BLAHdione [2-(4-chlorophenyl)-2-oxo-ethyl]…

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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) 3.84 1.69 -15.17 0 9 0 94 480.887 4 ↓
Mid Mid (pH 6-8) 3.84 2 -45.29 1 9 1 95 481.895 4 ↓

Parameters Provided:

ring.id = 7917
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 = 7917 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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