UCSF
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Popular Name: 2-(methylsulfanyl)-5-{(Z)-[2-(1H-pyrazol-1-yl)phenyl]methylidene}-1,3-thiazol-4-one 2-(methylsulfanyl)-5-{(Z)-[2-(1H…

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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) 2.64 -0.59 -17.68 0 4 0 47 301.396 3 ↓

Analogs

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Popular Name: 2-(hydroxyamino)-5-{(Z)-[2-(1H-pyrazol-1-yl)phenyl]methylidene}-1,3-thiazol-4-one 2-(hydroxyamino)-5-{(Z)-[2-(1H-p…

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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) 1.59 3.18 -54.33 1 6 -1 82 285.308 3 ↓
Hi High (pH 8-9.5) 2.51 5.26 -56.07 1 6 -1 86 285.308 2 ↓
Mid Mid (pH 6-8) 1.59 3.14 -25.49 2 6 0 80 286.316 3 ↓

Parameters Provided:

ring.id = 227986
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 = 227986 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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