UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

34550123
34550123
32209
32209
5870291
5870291

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Popular Name: (4Z)-4-[(4-isopropylphenyl)methylene]-3-phenyl-isoxazol-5-one (4Z)-4-[(4-isopropylphenyl)methy…

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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) 4.58 4.22 -10.56 0 3 0 43 291.35 3 ↓

Analogs

4526335
4526335

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Popular Name: (4Z)-3-(4-chlorophenyl)-4-[(2,4-dihydroxyphenyl)methylene]isoxazol-5-one (4Z)-3-(4-chlorophenyl)-4-[(2,4-…

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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) 3.18 4.57 -12.19 2 5 0 84 315.712 2 ↓

Parameters Provided:

ring.id = 100326
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 = 100326 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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