UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

1951589
1951589

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Popular Name: 3-phenethyloxy-2-(p-tolyl)chromone 3-phenethyloxy-2-(p-tolyl)chromone

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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) 5.97 3.34 -11.85 0 3 0 39 356.421 5 ↓

Analogs

1942075
1942075
1942076
1942076
1942078
1942078
1951589
1951589
40168664
40168664

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Popular Name: 2-(4-chlorophenyl)-3-phenethyloxy-chromone 2-(4-chlorophenyl)-3-phenethylox…

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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) 6.20 2.87 -10.66 0 3 0 39 376.839 5 ↓

Parameters Provided:

ring.id = 230168
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 = 230168 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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//zinc12.docking.org/results/combination?ring.id=230168&filter.purchasability=annotated

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