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3946078
3946078

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Popular Name: tetrahydroxy(methyl)BLAHtrione tetrahydroxy(methyl)BLAHtrione

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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) -0.68 -0.56 -19.05 4 8 0 141 374.345 0 ↓
Hi High (pH 8-9.5) -0.68 0.43 -57.05 3 8 -1 144 373.337 0 ↓
Hi High (pH 8-9.5) -0.68 1.24 -122.75 2 8 -2 147 372.329 0 ↓

Parameters Provided:

ring.id = 98869
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 = 98869 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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