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Popular Name: 6-nitro-2-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-benzo[de]isoquinoline-1,3(2H)-dione 6-nitro-2-(5-methyl-1,3,4-thiadi…

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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) 0.12 5.52 -46.64 2 4 1 50 246.334 2 ↓
Hi High (pH 8-9.5) 0.12 4.18 -10.89 1 4 0 45 245.326 2 ↓
Lo Low (pH 4.5-6) 0.12 5.98 -86.94 3 4 2 51 247.342 2 ↓

Parameters Provided:

ring.id = 418911
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 = 418911 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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