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Popular Name: 3-(4-methylpiperazin-1-yl)-4-[(2,2,6,6-tetramethyl-4-piperidyl)amino]cyclobut-3-ene-1,2-dione 3-(4-methylpiperazin-1-yl)-4-[(2…

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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) 0.15 1.31 -51.86 2 6 0 70 335.472 2 ↓
Mid Mid (pH 6-8) 0.15 3.62 -126.54 3 6 0 71 336.48 2 ↓
Mid Mid (pH 6-8) 0.15 1.27 -57.36 2 6 0 70 335.472 2 ↓

Parameters Provided:

ring.id = 583402
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 = 583402 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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