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Popular Name: (2S)-2-cyano-N-(o-tolyl)-3-oxo-3-(thiadiazol-4-yl)propanamide (2S)-2-cyano-N-(o-tolyl)-3-oxo-3…

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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) 1.50 5.25 -43.94 1 6 -1 102 285.308 4 ↓
Hi High (pH 8-9.5) 2.87 3.61 -124.29 0 6 -2 108 284.3 3 ↓
Lo Low (pH 4.5-6) 1.65 5.97 -12.34 1 6 0 96 286.316 4 ↓

Parameters Provided:

ring.id = 427336
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 = 427336 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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